SCHEMBL14833502

SCHEMBL14833502

COc1ccc(C2CNCCN2C(C)=O)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MMP1 P03956 1/20 0.44
MMP3 P08254 1/20 0.44
MMP7 P09237 1/20 0.44
MMP9 P14780 1/20 0.44
MMP13 P45452 1/20 0.44
MAOA P21397 2/20 0.43
CHRNA7 P36544 2/20 0.43
SMN1; SMN2 Q16637 2/20 0.43
TSHR P16473 1/20 0.43
RECQL P46063 1/20 0.43
KDM4E B2RXH2 1/20 0.43
NPC1 O15118 1/20 0.43
ALDH1A1 P00352 1/20 0.43
RAB9A P51151 1/20 0.43
HSD17B10 Q99714 1/20 0.43
MAOB P27338 1/20 0.43
KCNH2 Q12809 1/20 0.42
HTR3E A5X5Y0 1/20 0.42
HTR3B O95264 1/20 0.42
ADRB1 P08588 1/20 0.42

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
SCHEMBL7464685 0.90 USP19 (0.46) MMP1MMP3MMP7MMP9MMP13
SCHEMBL14833446 0.84 HTR2C (0.47) CHRNA7TSHRKDM4EALDH1A1ADRB1
SCHEMBL12520600 0.84 GAA (0.48) MMP1MMP3MMP7MMP9MMP13
SCHEMBL3338258 0.84 LMNA (0.44) MAOAMAOB
SCHEMBL1580100 0.82 POLB (0.54) TSHR
SCHEMBL31542128 0.81 DPP4 (0.42) SMN1; SMN2KDM4EALDH1A1
SCHEMBL778839 0.79 FPR1 (0.55) CHRNA7SMN1; SMN2ALDH1A1KCNH2
SCHEMBL7230204 0.78 ADRB1 (0.44) KDM4EALDH1A1KCNH2ADRB1
SCHEMBL659344 0.78 MAOA (0.49) MMP1MMP3MMP7MMP9MMP13
SCHEMBL7585368 0.76 POLB (0.39) MAOANPC1RAB9AMAOB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2760862-A1 6-(4-HYDROXY-PHENYL)-3-ALKYL-1H-PYRAZOLO[3,4-B]PYRIDINE-4-CARBOXYLIC ACID AMIDE DERIVATIVES AS KINASE INHIBITORS SANOFI (FR) 2014-08-06 EP disclosed
WO-2013045413-A1 6-(4-HYDROXY-PHENYL)-3-ALKYL-1H-PYRAZOLO[3,4-B]PYRIDINE-4-CARBOXYLIC ACID AMIDE DERIVATIVES AS KINASE INHIBITORS SANOFI (FR) 2013-04-04 WO disclosed