SCHEMBL9802391

SCHEMBL9802391

O=C1CC[C@@H](C(=O)N[C@H]2C(=O)N(CC(=O)N3CCCCC3)c3ccccc3C[C@@H]2c2ccccc2)N1

nearest known ligand 0.46

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CCKBR P32239 14/20 0.46
CCKAR P32238 3/20 0.44
ALDH1A1 P00352 1/20 0.42
CHRM2 P08172 3/20 0.40
CHRM4 P08173 3/20 0.40
CHRM1 P11229 3/20 0.40
CHRM3 P20309 3/20 0.40

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
SCHEMBL9802689 1.00 CCKBR (0.46) CCKBRCCKARALDH1A1CHRM2CHRM4
SCHEMBL9802697 1.00 CCKBR (0.46) CCKBRCCKARALDH1A1CHRM2CHRM4
SCHEMBL9802399 1.00 CCKBR (0.46) CCKBRCCKARALDH1A1CHRM2CHRM4
SCHEMBL9801983 0.99 CCKBR (0.46) CCKBRCCKARALDH1A1CHRM2CHRM4
SCHEMBL9802646 0.99 CCKBR (0.46) CCKBRCCKARALDH1A1CHRM2CHRM4
SCHEMBL9802635 0.99 CCKBR (0.46) CCKBRCCKARALDH1A1CHRM2CHRM4
SCHEMBL9801974 0.99 CCKBR (0.46) CCKBRCCKARALDH1A1CHRM2CHRM4
SCHEMBL9802171 0.89 PYGL (0.41) CCKBR
SCHEMBL9802290 0.89 PYGL (0.41) CCKBR
SCHEMBL9802184 0.89 PYGL (0.41) CCKBR

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-5055464-A Cognition activators, diuretics, antiulcer agents YOSHITOMI PHARMACEUTICAL INDUSTRIES LTD. (JP) 1991-10-08 US disclosed
EP-0322779-A2 Benzolactam compounds and pharmaceutical uses thereof Yoshitomi Pharmaceutical Industries, Ltd. (JP) 1989-07-05 EP disclosed