SCHEMBL14014960

SCHEMBL14014960

CCCOc1ccc(-c2cnc3c(C(=O)O)cnn3c2C2CCCCC2)cc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.42
KDM4E B2RXH2 3/20 0.42
PDE10A Q9Y233 1/20 0.40
NPC1 O15118 1/20 0.40
RAB9A P51151 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
LMNA P02545 2/20 0.39
KEAP1 Q14145 3/20 0.38
NFE2L2 Q16236 3/20 0.38
CAMKK1 Q8N5S9 2/20 0.38
CAMKK2 Q96RR4 2/20 0.38
TSHR P16473 3/20 0.38
MAPK1 P28482 2/20 0.38
DHODH Q02127 1/20 0.38
ATM Q13315 1/20 0.38
MAPT P10636 2/20 0.38
THRB P10828 1/20 0.38
S1PR1 P21453 1/20 0.38
ALOX15 P16050 1/20 0.37
RARA P10276 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
SCHEMBL14014496 0.88 KDM4E (0.56) ALDH1A1KDM4ENPC1RAB9ASMN1; SMN2
SCHEMBL14014510 0.85 MCL1 (0.43) KDM4ESMN1; SMN2DHODH
SCHEMBL14014888 0.84 CAMKK2 (0.47) ALDH1A1KDM4ENPC1RAB9ASMN1; SMN2
SCHEMBL14014880 0.84 KEAP1 (0.46) ALDH1A1KDM4ENPC1RAB9AKEAP1
SCHEMBL4710750 0.83 KDM4E (0.52) ALDH1A1KDM4ENPC1RAB9ASMN1; SMN2
SCHEMBL6211737 0.83 CAMKK2 (0.40) ALDH1A1KDM4ENPC1RAB9ASMN1; SMN2
SCHEMBL14014941 0.83 GCGR (0.45) ALDH1A1KDM4ECAMKK1CAMKK2
SCHEMBL4707198 0.82 KDM4E (0.39) ALDH1A1KDM4ENPC1RAB9ASMN1; SMN2
SCHEMBL14014957 0.82 AXL (0.41) ALDH1A1KDM4ENPC1RAB9ASMN1; SMN2
SCHEMBL4708838 0.82 BRS3 (0.46) ALDH1A1KDM4EKEAP1NFE2L2CAMKK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7449488-B2 Pyrazolopyrimidines as protein kinase inhibitors SCHERING CORPORATION (US) 2008-11-11 US disclosed
US-7449488-B2 Pyrazolopyrimidines as protein kinase inhibitors SCHERING CORPORATION (US) 2008-11-11 US disclosed
WO-2007044410-A1 PYRAZOLO [1,5-A] PYRIMIDINES AS PROTEIN KINASE INHIBITORS SCHERING CORPORATION (US) 2007-04-19 WO disclosed
US-7196111-B2 Pyrazolo[1,5a]pyrimidine compounds as antiviral agents SCHERING CORPORATION (US) 2007-03-27 US disclosed
US-7196111-B2 Pyrazolo[1,5a]pyrimidine compounds as antiviral agents SCHERING CORPORATION (US) 2007-03-27 US disclosed