SCHEMBL7236347

SCHEMBL7236347

Cc1ccc2c(c1)[C@H](c1cccc3c1OCO3)O[C@@H](CC(=O)N1CCCC(C(=O)O)C1)C(=O)N2CC(C)(C)C

nearest known ligand 0.47

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
FDFT1 P37268 11/20 0.47
KDM4E B2RXH2 1/20 0.35
MEN1 O00255 1/20 0.35
ALDH1A1 P00352 1/20 0.35
KMT2A Q03164 1/20 0.35

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
SCHEMBL7239836 0.94 FDFT1 (0.47) FDFT1
SCHEMBL7242554 0.93 FDFT1 (0.55) FDFT1
SCHEMBL7237324 0.92 FDFT1 (0.46) FDFT1
SCHEMBL7238386 0.92 FDFT1 (0.55) FDFT1
SCHEMBL7235973 0.91 FDFT1 (0.49) FDFT1
SCHEMBL7239081 0.90 FDFT1 (0.45) FDFT1
SCHEMBL7241816 0.87 FDFT1 (0.45) FDFT1
SCHEMBL7240963 0.87 FDFT1 (0.55) FDFT1
SCHEMBL9057178 0.87 FDFT1 (0.48) FDFT1
SCHEMBL8684184 0.87 FDFT1 (0.48) FDFT1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6537987-B1 This invention relates to certain benzoxazepinones and benzothiazepinones useful as hypocholesterolemic agents, hypotriglyceridemic agents, antiatherosclerosis agents, antifungal agents, anti-Alzheimer's agents or anti-acne PFIZER INC. 2003-03-25 US claimed
US-6537987-B1 This invention relates to certain benzoxazepinones and benzothiazepinones useful as hypocholesterolemic agents, hypotriglyceridemic agents, antiatherosclerosis agents, antifungal agents, anti-Alzheimer's agents or anti-acne PFIZER INC. 2003-03-25 US disclosed