SCHEMBL8490457

SCHEMBL8490457

CC(=O)Oc1c(OC(C)C)c(=O)oc2cc(OC/C=C(\C)CCC=C(C)C)ccc12

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAOB P27338 2/20 0.55
▸ MAOA P21397 1/20 0.55
▸ ALOX15 P16050 8/20 0.55
▸ KDM4E B2RXH2 5/20 0.55
▸ TDP1 Q9NUW8 4/20 0.55
▸ ALDH1A1 P00352 4/20 0.55
▸ CYP3A4 P08684 3/20 0.55
▸ MAPT P10636 3/20 0.55
▸ HPGD P15428 3/20 0.55
▸ HSD17B10 Q99714 3/20 0.55
▸ MAPK1 P28482 2/20 0.55
▸ GLA P06280 2/20 0.55
▸ NDUFS8 O00217 1/20 0.55
▸ COXFA4 O00483 1/20 0.55
▸ NDUFAB1 O14561 1/20 0.55
▸ NDUFA1 O15239 1/20 0.55
▸ NDUFS4 O43181 1/20 0.55
▸ NDUFB5 O43674 1/20 0.55
▸ NDUFB3 O43676 1/20 0.55
▸ NDUFC1 O43677 1/20 0.55

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
SCHEMBL8490468 1.00 MAOB (0.55) MAOBMAOAALOX15KDM4ETDP1
SCHEMBL8494677 0.96 MAOB (0.58) MAOBMAOAALOX15KDM4ETDP1
SCHEMBL8494669 0.96 MAOB (0.58) MAOBMAOAALOX15KDM4ETDP1
SCHEMBL8489787 0.94 TDP1 (0.53) MAOBMAOAALOX15KDM4ETDP1
SCHEMBL8489780 0.94 TDP1 (0.53) MAOBMAOAALOX15KDM4ETDP1
SCHEMBL8494097 0.94 MAOB (0.59) MAOBMAOAALOX15KDM4ETDP1
SCHEMBL8493460 0.94 TDP1 (0.54) MAOBMAOAALOX15KDM4ETDP1
SCHEMBL8493454 0.94 TDP1 (0.54) MAOBMAOAALOX15KDM4ETDP1
SCHEMBL8491510 0.93 ALOX15 (0.58) MAOBMAOAALOX15KDM4ETDP1
SCHEMBL8495824 0.93 TDP1 (0.53) MAOBMAOAALOX15KDM4ETDP1

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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