SCHEMBL10517239

SCHEMBL10517239

O=c1ccoc2cccc(OCCCCl)c12

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOB P27338 7/20 0.63
MAOA P21397 6/20 0.59
KCNA3 P22001 4/20 0.44
FTO Q9C0B1 1/20 0.42
HPGD P15428 4/20 0.42
MEN1 O00255 3/20 0.42
KMT2A Q03164 3/20 0.42
ALDH1A1 P00352 3/20 0.42
LMNA P02545 3/20 0.42
TDP1 Q9NUW8 3/20 0.37
KDM4E B2RXH2 2/20 0.37
POLB P06746 1/20 0.37
PKM P14618 1/20 0.37
TSHR P16473 1/20 0.37
CASP1 P29466 1/20 0.37
BRCA1 P38398 1/20 0.37
BLM P54132 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
MAPT P10636 1/20 0.37
PABPC1 P11940 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
SCHEMBL27746734 0.94 MAOB (0.63) MAOBMAOAKCNA3FTOHPGD
SCHEMBL11651182 0.82 MAOB (0.68) MAOBMAOAKCNA3MEN1KMT2A
SCHEMBL11655753 0.81 MAOB (0.59) MAOBMAOAKCNA3FTOHPGD
SCHEMBL12009588 0.80 MAOB (0.54) MAOBMAOAKCNA3HPGDMEN1
SCHEMBL28030972 0.79 SIGMAR1 (0.58) MAOBMAOAALDH1A1TDP1L3MBTL1
SCHEMBL28031507 0.78 SIGMAR1 (0.58) MAOBTDP1SIGMAR1
SCHEMBL28031540 0.77 SIGMAR1 (0.59) MAOBMAOAALDH1A1TDP1KDM4E
SCHEMBL12381921 0.77 GPR35 (0.62) MAOBMAOAKCNA3MEN1KMT2A
SCHEMBL29959798 0.76 MAOB (0.59) MAOBMAOAFTOHPGDMEN1
SCHEMBL1859617 0.76 MAOB (0.59) MAOBMAOAFTOHPGDMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0190015-B1 NOVEL 4H-1-BENZOPYRAN-4-ONES AND THEIR SULPHUR CONTAINING ANALOGS WARNER-LAMBERT COMPANY (US) 1989-01-25 EP disclosed
US-4678787-A PSYCHOSIS, SCHIZOPHRENIA WARNER-LAMBERT COMPANY (US) 1987-07-07 US disclosed
EP-0190015-A1 Novel 4H-1-benzopyran-4-ones and their sulphur containing analogs WARNER-LAMBERT COMPANY (US) 1986-08-06 EP disclosed