SCHEMBL7901204

SCHEMBL7901204

CCc1ccc(F)cc1C

nearest known ligand 0.41

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
P2RX7 Q99572 4/20 0.41
MAPK1 P28482 2/20 0.40
NR3C2 P08235 1/20 0.40
TSHR P16473 1/20 0.40
MMP1 P03956 3/20 0.39
MAPT P10636 2/20 0.38
PKM P14618 1/20 0.38
IDO1 P14902 1/20 0.38
AGXT P21549 1/20 0.38
MAOB P27338 1/20 0.38
NOS3 P29474 1/20 0.38
NOS1 P29475 1/20 0.38
NOS2 P35228 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
ALDH1A1 P00352 1/20 0.37

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
Formaldehyde SCHEMBL28284867 0.96 P2RX7 (0.39) P2RX7MAPK1NR3C2TSHRMMP1
SCHEMBL10304837 0.83 TNKS2 (0.45) MAPK1MAPTAGXTSMN1; SMN2ALDH1A1
SCHEMBL12656543 0.82 NR3C2 (0.41) P2RX7MAPK1NR3C2TSHRMMP1
SCHEMBL18361630 0.81 P2RX7 (0.42) P2RX7MAPK1NR3C2MMP1MAPT
SCHEMBL8240380 0.81 SLC6A4 (0.40) P2RX7MAPK1TSHRMAPTPKM
Ammonia Solution, Strong SCHEMBL6192622 0.80 NR3C2 (0.40) P2RX7MAPK1NR3C2TSHRMMP1
SCHEMBL3667517 0.80 IDO1 (0.40) MAPK1MAPTPKMIDO1AGXT
SCHEMBL12446733 0.80 KDM4E (0.45) IDO1AGXTMAOBALDH1A1
SCHEMBL13849235 0.80 PTGS2 (0.39) MAPTSMN1; SMN2
SCHEMBL14533298 0.79 P2RX7 (0.37) P2RX7NR3C2MMP1IDO1AGXT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230265110-A1 Proteasome Inhibitors TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2023-08-24 US disclosed
WO-2023115142-A1 ARYLSULPHONAMIDE COMPOUNDS Anaxis Pharma Pty Ltd (AU) 2023-06-29 WO disclosed
WO-2022268119-A1 SULFOXIMINE COMPOUND AND USE THEREOF 南京明德新药研发有限公司 2022-12-29 WO disclosed
EP-3608325-B1 POLYCYCLIC-CARBAMOYLPYRIDONE COMPOUNDS AND THEIR PHARMACEUTICAL USE GILEAD SCIENCES INC (US) 2022-07-06 EP disclosed
US-20220169648-A1 1,8-NAPHTHYRIDINONE COMPOUNDS AND USES THEREOF INTEGRAL BIOSCIENCES PVT. LTD. (IN) 2022-06-02 US disclosed
WO-2022115620-A1 4-FLUORO-(4-(4-BENZYL)PIPERIDIN-1-YL)(2-(PYRIMIDIN-4-YL)PYRIDIN-3-YL)METHANONE DERIVATIVES AND SIMILAR COMPOUNDS AS CYP46A1 INHIBITORS FOR THE TREATMENT OF NEURODEGENERATIVE DISORDERS SAGE THERAPEUTICS, INC. (US) 2022-06-02 WO disclosed
WO-2022078462-A1 NOVEL GLUTAMINE ANALOGS JACOBIO PHARMACEUTICALS CO., LTD. (CN) 2022-04-21 WO disclosed
US-11254670-B2 1,8-naphthyridinone compounds and uses thereof NUVATION BIO INC. (US) 2022-02-22 US disclosed
US-11241448-B2 Methods for cancer therapy MILLENNIUM PHARMACEUTICALS, INC. (US) 2022-02-08 US disclosed
US-20210177871-A1 METHODS FOR CANCER THERAPY TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2021-06-17 US disclosed
WO-2009062285-A1 INHIBITORS OF HUMAN IMMUNODEFICIENCY VIRUS REPLICATION BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2009-05-22 WO disclosed
EP-2055710-A1 Novel organic electroluminescent compounds and organic electroluminescent device using the same Gracel Display Inc. (KR) 2009-05-06 EP disclosed
WO-2008133344-A2 PIPERIDINE DERIVATIVE AND USE THEREOF TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2008-11-06 WO disclosed
US-20080194545-A1 ANTIMICROBIAL COMPOSITIONS AND METHODS OF USE TRIUS THERAPEUTICS (US) 2008-08-14 US disclosed
US-7402674-B2 7-Phenylamino-4-quinolone-3-carboxylic acid derivatives, process for their preparation and their use as medicaments SANOFI-AVENTIS DEUTSCHLAND GMBH, (DE) 2008-07-22 US disclosed
US-20080064734-A1 Anilinopyrazole derivatives useful for the treatment of diabetes BAYER PHARMACEUTICALS CORPORATION (US) 2008-03-13 US disclosed
US-7265144-B2 Anilinopyrazole derivatives useful for the treatment of diabetes BAYER PHARMACEUTICALS CORPORATION (US) 2007-09-04 US disclosed
US-20070167506-A1 SUBSTITUTED IMIDAZOLES PFIZER INC. (US) 2007-07-19 US disclosed
US-20070161685-A1 HETEROCYCLIC CETP INHIBITORS BRISTOL-MYERS SQUIBB COMPANY 2007-07-12 US disclosed
US-7230023-B2 Water-soluble triazole fungicide SANKYO COMPANY, LIMITED (JP) 2007-06-12 US 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 (9 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-20070161685-A1 HETEROCYCLIC CETP INHIBITORS CETP, CES1, NPC1 P2RX7 2998/4885MAPK1 3848/4885NR3C2 2393/4885
US-11254670-B2 1,8-naphthyridinone compounds and uses thereof NME1, ADORA2A, GPR68 P2RX7 165/4885MAPK1 510/4885NR3C2 719/4885
US-20080064734-A1 Anilinopyrazole derivatives useful for the treatment of diabetes IAPP, GLP1R, GPR119 P2RX7 100/4885MAPK1 1942/4885NR3C2 953/4885
US-20080194545-A1 ANTIMICROBIAL COMPOSITIONS AND METHODS OF USE ABCB11, FPR1, C5 P2RX7 473/4885MAPK1 3458/4885NR3C2 3135/4885
US-11241448-B2 Methods for cancer therapy TP53, BRCA1, PSMA1 P2RX7 4623/4885MAPK1 1529/4885NR3C2 832/4885
US-20070167506-A1 SUBSTITUTED IMIDAZOLES ABL1, TYR, CYP3A4 P2RX7 671/4885MAPK1 3695/4885NR3C2 2205/4885
US-20230265110-A1 Proteasome Inhibitors PSMB5, PSMG3, PSMB1 P2RX7 3544/4885MAPK1 2608/4885NR3C2 2705/4885
US-20220169648-A1 1,8-NAPHTHYRIDINONE COMPOUNDS AND USES THEREOF NME1, ADORA2A, GPR68 P2RX7 165/4885MAPK1 510/4885NR3C2 719/4885
US-20210177871-A1 METHODS FOR CANCER THERAPY TP53, BRCA1, PSMA1 P2RX7 4623/4885MAPK1 1529/4885NR3C2 832/4885

“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.