SCHEMBL7364003

SCHEMBL7364003

O=C(O)C=CCc1ccc(-c2ccccc2)cc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.52
ABCC4 O15439 1/20 0.52
GAA P10253 1/20 0.52
TSHR P16473 1/20 0.52
PTGS1 P23219 1/20 0.52
HTT P42858 1/20 0.52
FFAR1 O14842 1/20 0.48
ALDH1A1 P00352 3/20 0.47
KDM4E B2RXH2 1/20 0.47
MAPT P10636 1/20 0.47
MAOB P27338 1/20 0.46
GPR52 Q9Y2T5 1/20 0.46
MMP12 P39900 2/20 0.43
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
IDO1 P14902 1/20 0.42
AGXT P21549 1/20 0.42
TOP1 P11387 1/20 0.42
MMP13 P45452 1/20 0.42
TAAR1 Q96RJ0 1/20 0.42

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
SCHEMBL11219683 0.94 LPAR2 (0.42) LMNAABCC4GAATSHRPTGS1
SCHEMBL11219685 0.94 LPAR2 (0.42) LMNAABCC4GAATSHRPTGS1
SCHEMBL2555173 0.88 MAOB (0.61) LMNAALDH1A1MAOBGPR52TOP1
SCHEMBL2280548 0.88 MAOB (0.61) LMNAALDH1A1MAOBGPR52TOP1
SCHEMBL1233515 0.88 MAOB (0.61) LMNAALDH1A1MAOBGPR52TOP1
SCHEMBL11366685 0.88 MAOB (0.46) LMNATSHRALDH1A1MAOBTOP1
SCHEMBL8215239 0.87 LMNA (0.47) LMNAABCC4GAATSHRPTGS1
SCHEMBL29018928 0.84 AOC3 (0.51) MAOBGPR52AGXT
SCHEMBL11021262 0.80 FFAR1 (0.53) HTTFFAR1ALDH1A1MAPT
SCHEMBL11021258 0.80 FFAR1 (0.53) HTTFFAR1ALDH1A1MAPT

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-0871439-A4 SUBSTITUTED (ARYL, HETEROARYL, ARYLMETHYL OR HETEROARYLMETHYL) HYDROXAMIC ACID COMPOUNDS RHONE POULENC RORER PHARMA (US) 1999-07-21 EP disclosed
EP-0871439-A1 SUBSTITUTED (ARYL, HETEROARYL, ARYLMETHYL OR HETEROARYLMETHYL) HYDROXAMIC ACID COMPOUNDS RHONE-POULENC RORER PHARMACEUTICALS, INC. (US) 1998-10-21 EP disclosed
WO-1997024117-A1 SUBSTITUTED (ARYL, HETEROARYL, ARYLMETHYL OR HETEROARYLMETHYL) HYDROXAMIC ACID COMPOUNDS RHONE-POULENC RORER PHARMACEUTICALS INC. (US) 1997-07-10 WO disclosed