SCHEMBL724581

SCHEMBL724581

O=C(Cl)c1ccncc1F

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.52
ALOX15 P16050 1/20 0.52
KDM4C Q9H3R0 4/20 0.42
KDM4E B2RXH2 2/20 0.42
TDP1 Q9NUW8 2/20 0.42
L3MBTL1 Q9Y468 2/20 0.42
MEN1 O00255 1/20 0.42
KDM6B O15054 1/20 0.42
KDM4A O75164 1/20 0.42
MAPT P10636 1/20 0.42
THRB P10828 1/20 0.42
KMT2A Q03164 1/20 0.42
KDM4D Q6B0I6 1/20 0.42
LOXL2 Q9Y4K0 1/20 0.39
ABL1 P00519 1/20 0.39
GLA P06280 1/20 0.38
GAA P10253 1/20 0.38
SIRT3 Q9NTG7 1/20 0.37
ORAI1 Q96D31 3/20 0.36
STIM1 Q13586 2/20 0.36

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL2579028 0.83 ALDH1A1 (0.52) ALDH1A1ALOX15KDM4CKDM4ETDP1
SCHEMBL82604 0.81 KDM4C (0.59) ALDH1A1KDM4CKDM4ETDP1L3MBTL1
SCHEMBL29578794 0.81 KDM4C (0.59) ALDH1A1KDM4CKDM4ETDP1L3MBTL1
SCHEMBL2265522 0.80 KDM4C (0.47) ALDH1A1ALOX15KDM4CKDM4ETDP1
SCHEMBL25201864 0.79 KDM4C (0.42) ALDH1A1KDM4CKDM4ETDP1L3MBTL1
Hydrochloric Acid SCHEMBL1027857 0.79 KDM4C (0.57) ALDH1A1KDM4CKDM4ETDP1L3MBTL1
SCHEMBL30298673 0.79 TDP1 (0.55) ALDH1A1KDM4CKDM4ETDP1L3MBTL1
SCHEMBL459712 0.79 LOXL2 (0.44) ALDH1A1KDM4CKDM4ETDP1L3MBTL1
SCHEMBL2618803 0.79 TDP1 (0.55) ALDH1A1KDM4CKDM4ETDP1L3MBTL1
SCHEMBL20819380 0.79 ALDH1A1 (0.42) ALDH1A1KDM4CKDM4ETDP1L3MBTL1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 75 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12071437-B1 Pyrazolo[1,5-a]pyrido[4,3-e]pyrimidine-2-carboxylic acids as CK2 inhibitors King Faisal University (SA) 2024-08-27 US disclosed
US-20240270762-A1 PENICILLIN-BINDING PROTEIN INHIBITORS SPRING MILL PHARMA, INC. 2024-08-15 US disclosed
US-12012406-B1 Pyrido[4,3-e]pyrrolo[1,2-a]pyrimidine as CK2 inhibitors King Faisal University (SA) 2024-06-18 US disclosed
US-12012414-B1 Imidazo[1,5-a]pyrido[4,3-e]pyrimidines as CK2 inhibitors King Faisal University (SA) 2024-06-18 US disclosed
US-12012407-B1 Pyrazolo[1,5-a]pyrido[4,3-e]pyrimidine-3-carboxylic acids as CK2 inhibitors King Faisal University (SA) 2024-06-18 US disclosed
EP-4347607-A1 PENICILLIN-BINDING PROTEIN INHIBITORS Venatorx Pharmaceuticals, Inc. (US) 2024-04-10 EP disclosed
CN-117693511-A Penicillin binding protein inhibitors 维纳拓尔斯制药公司 2024-03-12 CN disclosed
CN-114591311-A Compounds that modulate intracellular calcium 钙医学公司 2022-06-07 CN disclosed
EP-3426638-B1 INHIBITORS OF INDOLEAMINE 2,3-DIOXYGENASE NETHERLANDS TRANSLATIONAL RES CENTER B V (NL) 2020-05-06 EP disclosed
US-10336738-B2 Compounds that modulate intracellular calcium CALCIMEDICA, INC. (US) 2019-07-02 US disclosed
US-7816535-B2 such as N-[4-(1,4-dimethyl-1,2,5,6-tetrahydro-pyridin-3-yl)-phenyl]-2,6-difluoro-benzamide; immunosuppressive agents; allergic disorders, and immune disorders SYNTA PHARMACEUTICALS CORP. (US) 2010-10-19 US disclosed
US-7816535-B2 such as N-[4-(1,4-dimethyl-1,2,5,6-tetrahydro-pyridin-3-yl)-phenyl]-2,6-difluoro-benzamide; immunosuppressive agents; allergic disorders, and immune disorders SYNTA PHARMACEUTICALS CORP. (US) 2010-10-19 US disclosed
EP-1848435-A2 COMPOUNDS FOR INFLAMMATION AND IMMUNE-RELATED USES Synta Pharmaceuticals Corporation (US) 2007-10-31 EP disclosed
US-20070249051-A1 such as N-[4-(1,4-dimethyl-1,2,5,6-tetrahydro-pyridin-3-yl)-phenyl]-2,6-difluoro-benzamide; immunosuppressive agents; allergic disorders, and immune disorders SYNTA PHARMACEUTICALS CORP. 2007-10-25 US disclosed
WO-2007087443-A2 VINYL-PHENYL DERIVATIVES FOR INFLAMMATION AND IMMUNE-RELATED USES SYNTA PHARMACEUTICALS CORP. (US) 2007-08-02 WO disclosed
WO-2006081391-A2 COMPOUNDS FOR INFLAMMATION AND IMMUNE-RELATED USES SYNTA PHARMACEUTICALS CORP. (US) 2006-08-03 WO disclosed
US-20060173021-A1 pyrazinyl, pyrimidinyl and pyridazinyl derivatives such asN-[5-(2-Chloro-5-trifluoromethyl-phenyl)-pyrazin-2-yl]-2,6-difluoro-benzamide, used as immunosuppressants for the treatmet or prevent inflammatory and immune disorders SYNTA PHARMACEUTICALS CORP. (US) 2006-08-03 US disclosed
EP-0878196-B1 KAINIC ACID NEURONOTOXICITY INHIBITORS AND PYRIDOTHIAZINE DERIVATIVES YAMANOUCHI PHARMA CO LTD (JP) 2003-09-03 EP disclosed
US-6133258-A PYRIDOTHIAZINE DERIVATIVE; FOR TREATMENT OF AMYOTROPHIC LATERAL SCLEROSIS, MULTIPLE SCLEROSIS, PAIN, GLAUCOMA YAMANOUCHI PHARMACEUTICAL CO., LTD. (JP) 2000-10-17 US disclosed
EP-0878196-A1 KAINIC ACID NEURONOTOXICITY INHIBITORS AND PYRIDOTHIAZINE DERIVATIVES YAMANOUCHI PHARMACEUTICAL CO. LTD. (JP) 1998-11-18 EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (8 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-12012407-B1 Pyrazolo[1,5-a]pyrido[4,3-e]pyrimidine-3-carboxylic acids as CK2 inhibitors CDK2, PDXK, CSNK2A3 ALDH1A1 3301/4885ALOX15 2586/4885KDM4C 2612/4885
US-12012406-B1 Pyrido[4,3-e]pyrrolo[1,2-a]pyrimidine as CK2 inhibitors CDK2, PDXK, SKP2 ALDH1A1 3997/4885ALOX15 2745/4885KDM4C 2377/4885
US-12071437-B1 Pyrazolo[1,5-a]pyrido[4,3-e]pyrimidine-2-carboxylic acids as CK2 inhibitors CDK2, PDXK, SKP2 ALDH1A1 3228/4885ALOX15 2535/4885KDM4C 2687/4885
US-10336738-B2 Compounds that modulate intracellular calcium ORAI1, SARAF, RYR2 ALDH1A1 4409/4885ALOX15 1014/4885KDM4C 4521/4885
US-12012414-B1 Imidazo[1,5-a]pyrido[4,3-e]pyrimidines as CK2 inhibitors CDK2, CSNK1A1, CSNK2A1 ALDH1A1 3763/4885ALOX15 3384/4885KDM4C 2322/4885
US-20070249051-A1 such as N-[4-(1,4-dimethyl-1,2,5,6-tetrahydro-pyridin-3-yl)-phenyl]-2,6-difluoro-benzamide; immunosuppressive agents; allergic disorders, and immune disorders IL4, IL5, IL2 ALDH1A1 2396/4885ALOX15 2664/4885KDM4C 697/4885
US-20240270762-A1 PENICILLIN-BINDING PROTEIN INHIBITORS PEPD, BPGM, EBPL ALDH1A1 2794/4885ALOX15 4334/4885KDM4C 3114/4885
US-20060173021-A1 pyrazinyl, pyrimidinyl and pyridazinyl derivatives such asN-[5-(2-Chloro-5-trifluoromethyl-phenyl)-pyrazin-2-yl]-2,6-difluoro-benzamide, used as immunosuppressants for the treatmet or prevent inflammatory and immune disorders TPMT, IL5, NAT1 ALDH1A1 2181/4885ALOX15 2805/4885KDM4C 2489/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.