SCHEMBL14015136

SCHEMBL14015136

Cc1cnc(Oc2ccccc2)cc1N

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LOXL2 Q9Y4K0 2/20 0.45
▸ LOX P28300 1/20 0.44
▸ SMN1; SMN2 Q16637 3/20 0.44
▸ CYP1A2 P05177 3/20 0.44
▸ CYP2C19 P33261 3/20 0.44
▸ NPC1 O15118 2/20 0.44
▸ RAB9A P51151 2/20 0.44
▸ CYP2C9 P11712 2/20 0.44
▸ ALDH1A1 P00352 5/20 0.43
▸ BCAT2 O15382 1/20 0.43
▸ KDM4E B2RXH2 4/20 0.43
▸ MEN1 O00255 3/20 0.43
▸ KMT2A Q03164 3/20 0.43
▸ HSD17B10 Q99714 2/20 0.43
▸ BRCA1 P38398 1/20 0.43
▸ HBB P68871 1/20 0.43
▸ NUDT1 P36639 1/20 0.43
▸ HTT P42858 2/20 0.42
▸ L3MBTL1 Q9Y468 2/20 0.42
▸ ROCK1 Q13464 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
SCHEMBL16792635 0.86 UHRF1 (0.46) LOXL2LOXSMN1; SMN2CYP1A2CYP2C19
SCHEMBL18181863 0.84 ALDH1A1 (0.47) LOXL2LOXSMN1; SMN2CYP1A2CYP2C19
SCHEMBL22530482 0.78 MAPT (0.45) LOXL2SMN1; SMN2CYP1A2CYP2C19NPC1
SCHEMBL29351922 0.78 MAPT (0.45) LOXL2SMN1; SMN2CYP1A2CYP2C19NPC1
SCHEMBL22117010 0.77 GABRG2 (0.48) LOXL2SMN1; SMN2RAB9AALDH1A1NUDT1
SCHEMBL29693800 0.76 ALDH1A1 (0.44) LOXL2LOXSMN1; SMN2CYP1A2CYP2C19
SCHEMBL16792623 0.76 SMN1; SMN2 (0.46) LOXL2LOXSMN1; SMN2CYP1A2CYP2C19
SCHEMBL16792742 0.76 LOXL2 (0.42) LOXL2LOXSMN1; SMN2CYP1A2CYP2C19
SCHEMBL30294911 0.74 NNMT (0.50) LOXL2LOXALDH1A1KDM4EMEN1
SCHEMBL15939077 0.74 NNMT (0.50) LOXL2LOXALDH1A1KDM4EMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7452880-B2 Substituted pyrazolo [3,4-d] pyrimidines and methods of using the same F. HOFFMANN-LA ROCHE AG (CH) 2008-11-18 — — US disclosed
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