SCHEMBL4079623

SCHEMBL4079623

COCNC(=O)c1cc(Cl)ccn1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4C Q9H3R0 1/20 0.54
NPC1 O15118 3/20 0.50
RAB9A P51151 3/20 0.50
ALDH1A1 P00352 2/20 0.50
MAPT P10636 1/20 0.50
L3MBTL1 Q9Y468 1/20 0.50
GRM5 P41594 2/20 0.45
CASP3 P42574 1/20 0.44
SENP8 Q96LD8 1/20 0.44
SENP7 Q9BQF6 1/20 0.44
SENP6 Q9GZR1 1/20 0.44
TSHR P16473 1/20 0.44
PYGL P06737 3/20 0.44
PYGM P11217 3/20 0.44
CYP1A2 P05177 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.42
TP53 P04637 1/20 0.41
DDR1 Q08345 1/20 0.41
KMT2A Q03164 2/20 0.41
MEN1 O00255 1/20 0.41

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
SCHEMBL7083262 0.83 CTSA (0.45) NPC1RAB9AALDH1A1MAPTL3MBTL1
SCHEMBL620738 0.83 L3MBTL1 (0.58) KDM4CNPC1RAB9AALDH1A1MAPT
SCHEMBL3945417 0.82 ALDH1A1 (0.51) KDM4CRAB9AALDH1A1L3MBTL1GRM5
SCHEMBL3735813 0.82 GRM5 (0.49) RAB9AALDH1A1GRM5TSHRPYGL
SCHEMBL1054692 0.80 KDM4C (0.58) KDM4CNPC1RAB9AALDH1A1MAPT
SCHEMBL6072144 0.80 L3MBTL1 (0.55) KDM4CNPC1RAB9AALDH1A1MAPT
SCHEMBL620675 0.80 KDM4C (0.54) KDM4CNPC1RAB9AALDH1A1MAPT
SCHEMBL306105 0.80 SMN1; SMN2 (0.62) KDM4CNPC1RAB9AALDH1A1MAPT
SCHEMBL25368936 0.79 KDM4C (0.54) KDM4CNPC1RAB9AALDH1A1MAPT
SCHEMBL31132286 0.79 KDM4C (0.54) KDM4CNPC1RAB9AALDH1A1MAPT

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 13 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10308637-B2 Therapeutic inhibitory compounds LIFESCI PHARMACEUTICALS, INC. (BB) 2019-06-04 US disclosed
US-20190002437-A1 THERAPEUTIC INHIBITORY COMPOUNDS ATTUNE PHARMACEUTICALS, INC. 2019-01-03 US disclosed
US-10023557-B2 Therapeutic inhibitory compounds LIFESCI PHARMACEUTICALS, INC. (BB) 2018-07-17 US disclosed
EP-3316884-A1 THERAPEUTIC INHIBITORY COMPOUDS Lifesci Pharmaceuticals, Inc. (BB) 2018-05-09 EP disclosed
US-20170029406-A1 THERAPEUTIC INHIBITORY COMPOUNDS ATTUNE PHARMACEUTICALS, INC. 2017-02-02 US disclosed
WO-2017001924-A1 THERAPEUTIC INHIBITORY COMPOUDS LIFESCI PHARMACEUTICALS, INC. (BB) 2017-01-05 WO disclosed
EP-2903989-A1 PYRROLO[2,3-D]PYRIMIDINE TROPOMYOSIN-RELATED KINASE INHIBITORS Pfizer Limited (GB) 2015-08-12 EP disclosed
US-20150218172-A1 Pyrrolo[2,3-D]Pyrimidine Tropomyosin-Related Kinase Inhibitors PFIZER LIMITED (GB) 2015-08-06 US disclosed
WO-2014053967-A1 PYRROLO[2,3-D]PYRIMIDINE TROPOMYOSIN-RELATED KINASE INHIBITORS PFIZER LIMITED (GB) 2014-04-10 WO disclosed
US-7595325-B2 Substituted pyrrolo[2,3-d]pyrimidine derivatives useful in cancer treatment PFIZER INC. (US) 2009-09-29 US disclosed
EP-1773836-A1 PYRROLOPYRIMIDINE DERIVATIVES USEFUL IN CANCER TREATMENT Pfizer Products Inc. (US) 2007-04-18 EP disclosed
US-20060035912-A1 Pyrrolopyrimidine derivatives useful in cancer treatment PFIZER INC 2006-02-16 US disclosed
WO-2005116035-A1 PYRROLOPYRIMIDINE DERIVATIVES USEFUL IN CANCER TREATMENT PFIZER PRODUCTS INC. (US) 2005-12-08 WO 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 (6 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-10308637-B2 Therapeutic inhibitory compounds KLKB1, SERPINB1, SERPINE1 KDM4C 723/4885NPC1 959/4885RAB9A 2909/4885
US-20170029406-A1 THERAPEUTIC INHIBITORY COMPOUNDS KLKB1, SERPINB1, SERPINE1 KDM4C 723/4885NPC1 959/4885RAB9A 2909/4885
US-20060035912-A1 Pyrrolopyrimidine derivatives useful in cancer treatment TP53, DPYD, CCNT1 KDM4C 934/4885NPC1 2090/4885RAB9A 2612/4885
US-10023557-B2 Therapeutic inhibitory compounds KLKB1, SERPINB1, SERPINE1 KDM4C 723/4885NPC1 959/4885RAB9A 2909/4885
US-20150218172-A1 Pyrrolo[2,3-D]Pyrimidine Tropomyosin-Related Kinase Inhibitors MUSK, DMPK, TPM3 KDM4C 3604/4885NPC1 4431/4885RAB9A 2661/4885
US-20190002437-A1 THERAPEUTIC INHIBITORY COMPOUNDS KLKB1, SERPINB1, SERPINE1 KDM4C 723/4885NPC1 959/4885RAB9A 2909/4885

“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.