SCHEMBL14014496

SCHEMBL14014496

COc1ccc(-c2cnc3c(C(=O)O)cnn3c2C2CCCCC2)cc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.56
ALDH1A1 P00352 3/20 0.56
AXL P30530 1/20 0.45
FLT3 P36888 1/20 0.45
TYRO3 Q06418 1/20 0.45
MERTK Q12866 1/20 0.45
SMN1; SMN2 Q16637 2/20 0.42
KEAP1 Q14145 1/20 0.42
NFE2L2 Q16236 1/20 0.42
HPGD P15428 3/20 0.42
KMT2A Q03164 3/20 0.42
NPC1 O15118 2/20 0.42
RAB9A P51151 2/20 0.42
KDR P35968 3/20 0.41
EGLN1 Q9GZT9 1/20 0.40
MAPT P10636 3/20 0.39
MEN1 O00255 2/20 0.39
CAMKK1 Q8N5S9 1/20 0.39
CAMKK2 Q96RR4 1/20 0.39
LMNA P02545 2/20 0.39

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
SCHEMBL4708491 0.89 HSD17B10 (0.47) KDM4EALDH1A1AXLFLT3TYRO3
SCHEMBL14014470 0.88 KDM4E (0.47) KDM4EALDH1A1SMN1; SMN2HPGDNPC1
SCHEMBL14014888 0.88 CAMKK2 (0.47) KDM4EALDH1A1AXLFLT3TYRO3
SCHEMBL14014939 0.88 KDM4E (0.48) KDM4EALDH1A1KEAP1NFE2L2HPGD
SCHEMBL14014960 0.88 ALDH1A1 (0.42) KDM4EALDH1A1SMN1; SMN2KEAP1NFE2L2
SCHEMBL14014880 0.88 KEAP1 (0.46) KDM4EALDH1A1AXLFLT3TYRO3
SCHEMBL6211737 0.87 CAMKK2 (0.40) KDM4EALDH1A1SMN1; SMN2KEAP1NFE2L2
SCHEMBL4710750 0.87 KDM4E (0.52) KDM4EALDH1A1AXLFLT3TYRO3
SCHEMBL14014941 0.86 GCGR (0.45) KDM4EALDH1A1CAMKK1CAMKK2ABL1
SCHEMBL4707198 0.86 KDM4E (0.39) KDM4EALDH1A1SMN1; SMN2KEAP1NFE2L2

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 4 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
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