SCHEMBL9265492

SCHEMBL9265492

CC(=O)c1ccc2c(c1)[C@H](NC(=O)Nc1ccccc1)[C@@H](O)C(C)(C)O2

nearest known ligand 0.64

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ KCNA5 P22460 1/20 0.53
▸ ABCC9 O60706 2/20 0.49
▸ MEN1 O00255 1/20 0.47
▸ KMT2A Q03164 1/20 0.47
▸ NPC1 O15118 1/20 0.46
▸ MAPT P10636 1/20 0.46
▸ RAB9A P51151 1/20 0.46
▸ SMN1; SMN2 Q16637 1/20 0.46
▸ TAAR1 Q96RJ0 1/20 0.46

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
SCHEMBL9265505 1.00 KCNA5 (0.53) KCNA5ABCC9MEN1KMT2ANPC1
SCHEMBL9265483 1.00 KCNA5 (0.53) KCNA5ABCC9MEN1KMT2ANPC1
SCHEMBL7722209 0.85 ABCC9 (0.64) ABCC9
SCHEMBL8343023 0.85 ABCC9 (0.64) ABCC9
SCHEMBL3303489 0.85 ABCC9 (0.64) ABCC9
SCHEMBL8343026 0.85 ABCC9 (0.64) ABCC9
SCHEMBL16027515 0.85 ABCC9 (0.56) ABCC9
SCHEMBL10886662 0.84 ABCC9 (0.58) ABCC9
SCHEMBL9689218 0.84 ABCC9 (0.50) KCNA5ABCC9
SCHEMBL9689208 0.84 ABCC9 (0.50) KCNA5ABCC9

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-0462761-A2 Benzopyran derivatives and heterocyclic analogs thereof as antiischemic agents E.R. SQUIBB & SONS, INC. (US) 1991-12-27 — — EP claimed
US-5466817-A Benzopyran derivatives and heterocyclic analogs thereof as antiischemic agents E.R. SQUIBB & SONS, INC. (US) 1995-11-14 — — US disclosed
US-5276168-A Benzopyran derivatives and heterocyclic analogs thereof as antiischemic agents E. R. SQUIBB & SONS, INC. (US) 1994-01-04 — — US disclosed
EP-0462761-A2 Benzopyran derivatives and heterocyclic analogs thereof as antiischemic agents E.R. SQUIBB & SONS, INC. (US) 1991-12-27 — — EP disclosed
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