SCHEMBL13869237

SCHEMBL13869237

CCCc1ccc2c(ccc3oc(=O)c(-c4cccc(-c5cc6c(ccc7cc(CCC)ccc76)oc5=O)c4)cc32)c1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 3/20 0.44
▸ ALDH1A1 P00352 3/20 0.44
▸ MAPT P10636 2/20 0.44
▸ HPGD P15428 1/20 0.44
▸ ALOX15 P16050 1/20 0.44
▸ TSHR P16473 1/20 0.44
▸ CASP1 P29466 1/20 0.44
▸ CASP7 P55210 1/20 0.44
▸ HSD17B10 Q99714 1/20 0.44
▸ MAOB P27338 9/20 0.43
▸ MAOA P21397 1/20 0.40
▸ GPR55 Q9Y2T6 1/20 0.40
▸ MEN1 O00255 1/20 0.39
▸ ESR1 P03372 1/20 0.39
▸ POLB P06746 1/20 0.39
▸ KMT2A Q03164 1/20 0.39
▸ NPC1 O15118 1/20 0.38
▸ RAB9A P51151 1/20 0.38
▸ SMN1; SMN2 Q16637 1/20 0.38
▸ GAPDH P04406 2/20 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
SCHEMBL13869284 0.99 KDM4E (0.43) KDM4EALDH1A1MAPTHPGDALOX15
SCHEMBL13869319 0.90 MAOB (0.42) KDM4EALDH1A1MAPTHPGDALOX15
SCHEMBL13869509 0.89 MAOB (0.39) KDM4EALDH1A1MAPTHPGDALOX15
SCHEMBL13869640 0.89 MAOB (0.44) KDM4EALDH1A1MAPTHPGDALOX15
SCHEMBL13869459 0.86 PIM1 (0.41) KDM4EALDH1A1MAPTHPGDALOX15
SCHEMBL13869388 0.85 GPR55 (0.45) KDM4EALDH1A1MAPTHPGDALOX15
SCHEMBL13869679 0.85 SIRT2 (0.37) KDM4EALDH1A1MAPTHPGDALOX15
SCHEMBL13869798 0.84 KDM4E (0.35) KDM4EALDH1A1MAPTHPGDALOX15
SCHEMBL13869428 0.84 KDM4E (0.39) KDM4EALDH1A1MAPTHPGDALOX15
SCHEMBL13869339 0.83 KDM4E (0.40) KDM4EALDH1A1MAPTHPGDALOX15

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-7514158-B2 Coumarin compound KABUSHIKI KAISHA HAYASHIBARA SEIBUTSU KAGAKU KENKYUJO (JP) 2009-04-07 — — US disclosed
US-7514158-B2 Coumarin compound KABUSHIKI KAISHA HAYASHIBARA SEIBUTSU KAGAKU KENKYUJO (JP) 2009-04-07 — — US disclosed
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