SCHEMBL10888766

SCHEMBL10888766

C=CC(=O)N[C@H]1c2cc(C#N)ccc2OC(C)(C)[C@@H]1O

nearest known ligand 0.71

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ ABCC9 O60706 9/20 0.71
▸ ABCB1 P08183 10/20 0.62

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
SCHEMBL9273379 0.87 ABCC9 (0.78) ABCC9ABCB1
SCHEMBL9532318 0.87 ABCC9 (0.78) ABCC9ABCB1
SCHEMBL9532337 0.87 ABCC9 (0.78) ABCC9ABCB1
SCHEMBL9273375 0.87 ABCC9 (0.78) ABCC9ABCB1
SCHEMBL9273381 0.87 ABCC9 (0.78) ABCC9ABCB1
SCHEMBL9358561 0.85 ABCC9 (0.75) ABCC9ABCB1
SCHEMBL9358552 0.85 ABCC9 (0.75) ABCC9ABCB1
SCHEMBL9354137 0.84 ABCC9 (0.73) ABCC9ABCB1
SCHEMBL9270451 0.83 ABCC9 (0.63) ABCC9ABCB1
SCHEMBL9271003 0.83 ABCC9 (0.63) ABCC9ABCB1

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0095316-B1 PHARMACEUTICALLY ACTIVE AMINOBENZOPYRANS BEECHAM GROUP PLC (GB) 1986-12-03 — — EP claimed
EP-0095316-B1 PHARMACEUTICALLY ACTIVE AMINOBENZOPYRANS BEECHAM GROUP PLC (GB) 1986-12-03 — — EP disclosed
US-4568692-A LOWERING BLOOD PRESSURE BEECHAM GROUP P.L.C. 1986-02-04 — — US disclosed
US-4481214-A 4-Acylaminobenzopyrans useful as anti-hypertensive agents BEECHAM GROUP P.L.C. (GB) 1984-11-06 — — US disclosed
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