SCHEMBL8491160

SCHEMBL8491160

CCCCCCCCCCOc1c(OC(C)C)c2ccc(OCC=C(C)CCC=C(C)C)cc2oc1=O

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAOB P27338 2/20 0.51
▸ MAOA P21397 1/20 0.51
▸ ALOX15 P16050 8/20 0.51
▸ TDP1 Q9NUW8 4/20 0.51
▸ NDUFS8 O00217 4/20 0.51
▸ COXFA4 O00483 4/20 0.51
▸ NDUFAB1 O14561 4/20 0.51
▸ NDUFA1 O15239 4/20 0.51
▸ NDUFS4 O43181 4/20 0.51
▸ NDUFB5 O43674 4/20 0.51
▸ NDUFB3 O43676 4/20 0.51
▸ NDUFC1 O43677 4/20 0.51
▸ NDUFA2 O43678 4/20 0.51
▸ NDUFS5 O43920 4/20 0.51
▸ NDUFS7 O75251 4/20 0.51
▸ NDUFS2 O75306 4/20 0.51
▸ NDUFS6 O75380 4/20 0.51
▸ NDUFB1 O75438 4/20 0.51
▸ NDUFS3 O75489 4/20 0.51
▸ NDUFB6 O95139 4/20 0.51

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
SCHEMBL8491154 1.00 MAOB (0.51) MAOBMAOAALOX15TDP1NDUFS8
SCHEMBL8489902 0.97 ALOX15 (0.51) MAOBMAOAALOX15TDP1NDUFS8
SCHEMBL8490549 0.97 TDP1 (0.49) MAOBMAOAALOX15TDP1NDUFS8
SCHEMBL8489908 0.97 ALOX15 (0.51) MAOBMAOAALOX15TDP1NDUFS8
SCHEMBL8490543 0.97 TDP1 (0.49) MAOBMAOAALOX15TDP1NDUFS8
SCHEMBL8497096 0.93 KDM4E (0.49) MAOBMAOAALOX15TDP1NDUFS8
SCHEMBL8495046 0.93 TDP1 (0.49) MAOBMAOAALOX15TDP1NDUFS8
SCHEMBL8493476 0.93 KDM4E (0.49) MAOBMAOAALOX15TDP1NDUFS8
SCHEMBL8495051 0.93 TDP1 (0.49) MAOBMAOAALOX15TDP1NDUFS8
SCHEMBL8493485 0.93 KDM4E (0.49) MAOBMAOAALOX15TDP1NDUFS8

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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