SCHEMBL9275028

SCHEMBL9275028

CCSc1ccc2[nH]c(=O)oc(=O)c2c1

nearest known ligand 0.47

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ F2 P00734 1/20 0.47
▸ CFD P00746 1/20 0.47
▸ MAOA P21397 10/20 0.47
▸ MAOB P27338 10/20 0.47
▸ ACHE P22303 2/20 0.44
▸ KDM4E B2RXH2 1/20 0.42
▸ ALDH1A1 P00352 1/20 0.42
▸ GAA P10253 1/20 0.42
▸ MAPT P10636 1/20 0.42
▸ HPGD P15428 1/20 0.42
▸ TSHR P16473 1/20 0.42
▸ HSD17B10 Q99714 1/20 0.42
▸ TYMS P04818 1/20 0.41
▸ ELANE P08246 4/20 0.39
▸ NOS1 P29475 1/20 0.38
▸ PDE3B Q13370 1/20 0.37
▸ PDE3A Q14432 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
SCHEMBL11162914 0.86 MAOA (0.43) F2CFDMAOAMAOBACHE
SCHEMBL9276075 0.84 MAOA (0.44) F2CFDMAOAMAOBACHE
SCHEMBL6862707 0.84 KDM4E (0.58) F2CFDMAOAMAOBACHE
SCHEMBL11162977 0.79 F2 (0.47) F2CFDMAOAMAOBACHE
SCHEMBL10342820 0.76 MAOA (0.57) F2CFDMAOAMAOBACHE
SCHEMBL24616836 0.76 F2 (0.47) F2CFDMAOAMAOBACHE
SCHEMBL9272079 0.75 MAOA (0.55) F2CFDMAOAMAOBACHE
SCHEMBL10342823 0.74 MAOA (0.54) F2CFDMAOAMAOBACHE
SCHEMBL30908765 0.74 LMNA (0.58) F2CFDMAOAMAOBACHE
SCHEMBL62706 0.74 LMNA (0.58) F2CFDMAOAMAOBACHE

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-0639182-A1 QUINOLINE DERIVATIVES FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1995-02-22 — — EP disclosed
WO-1992018483-A1 QUINOLINE DERIVATIVES FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1992-10-29 — — WO disclosed
Send feedback