SCHEMBL13680467

SCHEMBL13680467

Cc1ccc(-c2ccc(OC(N)=O)cc2)o1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KIF11 P52732 1/20 0.46
NQO2 P16083 5/20 0.44
GSK3B P49841 4/20 0.42
KDM4E B2RXH2 3/20 0.39
ALDH1A1 P00352 3/20 0.39
MAPT P10636 2/20 0.39
PKM P14618 1/20 0.39
HPGD P15428 2/20 0.39
LMNA P02545 1/20 0.39
PRNP P04156 1/20 0.39
HSD17B10 Q99714 1/20 0.39
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
NPC1 O15118 1/20 0.39
GAA P10253 1/20 0.39
RAB9A P51151 1/20 0.39
PRSS1 P07477 1/20 0.38
TMPRSS15 P98073 1/20 0.38
ADAMTS4 O75173 1/20 0.38
EGFR P00533 1/20 0.38

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
SCHEMBL13680520 0.85 LMNA (0.53) NQO2GSK3BKDM4EALDH1A1MAPT
SCHEMBL13680561 0.81 RAB9A (0.59) KDM4EALDH1A1MAPTPKMHPGD
SCHEMBL13680512 0.81 ALDH1A1 (0.45) NQO2GSK3BKDM4EALDH1A1MAPT
SCHEMBL13680503 0.77 GSK3B (0.62) NQO2GSK3BKDM4EALDH1A1HPGD
SCHEMBL23197679 0.75 TDP1 (0.56) NQO2GSK3BKDM4EALDH1A1MAPT
SCHEMBL7647138 0.74 KIF11 (0.59) KIF11ALDH1A1MAPTLMNAHSD17B10
SCHEMBL13680560 0.74 GSK3B (0.59) NQO2GSK3BKDM4EALDH1A1MAPT
SCHEMBL13680488 0.73 KIF11 (0.59) KIF11GSK3BKDM4EALDH1A1MAPT
SCHEMBL6284986 0.73 KMT2A (0.64) KIF11ALDH1A1MAPTPKMLMNA
SCHEMBL13680879 0.72 ALDH1A1 (0.48) KIF11NQO2KDM4EALDH1A1MAPT

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
US-7582658-B2 Bicyclic compound ASAHI KASEI PHARMA CORPORATION (JP) 2009-09-01 US disclosed
US-7582658-B2 Bicyclic compound ASAHI KASEI PHARMA CORPORATION (JP) 2009-09-01 US disclosed