SCHEMBL8491286

SCHEMBL8491286

CC(C)=CCC/C(C)=C/COc1ccc2c(OC/C=C(\C)CCC=C(C)C)c(OC(=O)c3ccccc3)c(=O)oc2c1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAOB P27338 2/20 0.56
▸ MAOA P21397 1/20 0.56
▸ ALOX15 P16050 8/20 0.53
▸ KDM4E B2RXH2 6/20 0.53
▸ ALDH1A1 P00352 6/20 0.53
▸ TDP1 Q9NUW8 4/20 0.53
▸ HPGD P15428 4/20 0.53
▸ MAPT P10636 4/20 0.53
▸ CYP3A4 P08684 3/20 0.53
▸ GLA P06280 3/20 0.53
▸ MAPK1 P28482 2/20 0.53
▸ HSD17B10 Q99714 2/20 0.53
▸ NDUFS8 O00217 1/20 0.53
▸ COXFA4 O00483 1/20 0.53
▸ NDUFAB1 O14561 1/20 0.53
▸ NDUFA1 O15239 1/20 0.53
▸ NDUFS4 O43181 1/20 0.53
▸ NDUFB5 O43674 1/20 0.53
▸ NDUFB3 O43676 1/20 0.53
▸ NDUFC1 O43677 1/20 0.53

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
SCHEMBL8493594 0.97 MAOB (0.57) MAOBMAOAALOX15KDM4EALDH1A1
SCHEMBL8495684 0.96 MAOB (0.56) MAOBMAOAALOX15KDM4EALDH1A1
SCHEMBL8490595 0.96 MAOB (0.55) MAOBMAOAALOX15KDM4EALDH1A1
SCHEMBL8496115 0.96 MAOB (0.55) MAOBMAOAALOX15KDM4EALDH1A1
SCHEMBL8490606 0.96 MAOB (0.55) MAOBMAOAALOX15KDM4EALDH1A1
SCHEMBL8496124 0.96 MAOB (0.55) MAOBMAOAALOX15KDM4EALDH1A1
SCHEMBL8494308 0.95 MAOB (0.56) MAOBMAOAALOX15KDM4EALDH1A1
SCHEMBL8495490 0.95 MAOB (0.52) MAOBMAOAALOX15KDM4EALDH1A1
SCHEMBL8494313 0.95 MAOB (0.56) MAOBMAOAALOX15KDM4EALDH1A1
SCHEMBL8494038 0.95 KDM4E (0.50) MAOBMAOAALOX15KDM4EALDH1A1

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-0598117-B1 BENZOPYRAN DERIVATIVE AND ANTIALLERGIC AGENT CONTAINING THE SAME AS ACTIVE INGREDIENT DAINIPPON INK & CHEMICALS (JP) 1999-06-30 — — EP disclosed
US-5428059-A Benzopyran derivatives and an anti-allergic agent possessing the same as the active ingredient DAINIPPON INK & CHEMICALS, INC. (JP) 1995-06-27 — — US disclosed
EP-0598117-A1 BENZOPYRAN DERIVATIVE AND ANTIALLERGIC AGENT CONTAINING THE SAME AS ACTIVE INGREDIENT DAINIPPON INK AND CHEMICALS, INC. (JP) 1994-05-25 — — EP disclosed
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