SCHEMBL9618068

SCHEMBL9618068

O=CSc1coc2ccccc2c1=O

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAOB P27338 9/20 0.57
▸ MAOA P21397 6/20 0.57
▸ PTPN1 P18031 1/20 0.57
▸ PTGS2 P35354 1/20 0.44
▸ ALDH1A1 P00352 6/20 0.43
▸ KDM4E B2RXH2 4/20 0.43
▸ MAPT P10636 4/20 0.43
▸ GLA P06280 1/20 0.42
▸ CYP3A4 P08684 1/20 0.42
▸ HPGD P15428 1/20 0.42
▸ PGAM1 P18669 1/20 0.42
▸ CASP1 P29466 1/20 0.42
▸ CASP7 P55210 1/20 0.42
▸ SMN1; SMN2 Q16637 1/20 0.42
▸ HSD17B10 Q99714 1/20 0.42
▸ LMNA P02545 1/20 0.42
▸ TDP1 Q9NUW8 1/20 0.42
▸ L3MBTL1 Q9Y468 1/20 0.42
▸ ADORA2B P29275 1/20 0.41
▸ CYP17A1 P05093 1/20 0.41

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
SCHEMBL11394273 0.79 MAOB (0.51) MAOBMAOAPTPN1PTGS2ALDH1A1
SCHEMBL8786734 0.79 MAOB (0.51) MAOBMAOAPTPN1PTGS2ALDH1A1
SCHEMBL11639718 0.79 MAOB (0.51) MAOBMAOAPTPN1PTGS2ALDH1A1
SCHEMBL9246490 0.76 MAOB (0.51) MAOBMAOAPTPN1PTGS2ALDH1A1
SCHEMBL29016986 0.75 MAOB (0.47) MAOBMAOAPTPN1PTGS2ALDH1A1
SCHEMBL11405457 0.75 PTGS2 (0.50) MAOBMAOAPTPN1PTGS2SMN1; SMN2
SCHEMBL9618120 0.75 MAOB (0.60) MAOBMAOAPTPN1ALDH1A1KDM4E
SCHEMBL29952282 0.73 PTPN1 (1.00) MAOBMAOAPTPN1PTGS2ALDH1A1
SCHEMBL127924 0.73 PTPN1 (1.00) MAOBMAOAPTPN1PTGS2ALDH1A1
SCHEMBL29277424 0.69 MAOB (0.67) MAOBMAOAPTPN1PTGS2ALDH1A1

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
JP-62201967-A — — None — — JP disclosed
JP-4279580-A — — None — — JP disclosed
JP-H04279580-A CHROMONE-BASED COMPOUND MITSUBISHI KASEI CORP 1992-10-05 — — JP disclosed
JP-S62201967-A DIARYLMETHANE COMPOUND MITSUBISHI CHEM IND LTD 1987-09-05 — — JP disclosed
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