SCHEMBL9307698

SCHEMBL9307698

CC1(C(=O)c2cc(F)cc(OCc3ccc4ccccc4c3)c2)COC1

nearest known ligand 0.50

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 13/20 0.50
MAOB P27338 2/20 0.41
MRGPRX4 Q96LA9 1/20 0.40
RAB9A P51151 1/20 0.40

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
SCHEMBL9308573 0.89 KMT2A (0.50) MAOBMRGPRX4RAB9A
SCHEMBL9307724 0.86 ALOX5 (0.45) ALOX5
SCHEMBL9307584 0.80 ALOX5 (0.49) ALOX5MAOBMRGPRX4RAB9A
SCHEMBL9000918 0.76 ALOX5 (0.46) ALOX5MAOBMRGPRX4RAB9A
SCHEMBL9221371 0.72 ALOX5 (0.68) ALOX5
SCHEMBL9081307 0.71 ALOX5 (0.52) ALOX5MRGPRX4RAB9A
SCHEMBL26358151 0.70 MEN1 (0.73) ALOX5MRGPRX4RAB9A
SCHEMBL9228198 0.70 ALOX5 (0.74) ALOX5
SCHEMBL9229588 0.69 ALOX5 (0.48) ALOX5
SCHEMBL9370131 0.69 CASP3 (0.51) ALOX5

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-5354865-A Enzyme inhibitor and inhibiting the leukotriene biosynthesis ABBOTT LABORATORIES (US) 1994-10-11 US disclosed
WO-1994005281-A1 PHENYLMETHYL DERIVATIVES HAVING LIPOXYGENASE INHIBITORY ACTIVITY ABBOTT LABORATORIES (US) 1994-03-17 WO disclosed