SCHEMBL6377600

SCHEMBL6377600

OC1(C#Cc2cnc(-c3ccccn3)cc2Cc2ccccc2)CN2CCC1CC2

nearest known ligand 0.53

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
FDFT1 P37268 4/20 0.53
MMP13 P45452 7/20 0.42
MMP2 P08253 3/20 0.41
CHRM2 P08172 1/20 0.39
CHRM4 P08173 1/20 0.39
CHRM5 P08912 1/20 0.39
CHRM1 P11229 1/20 0.39
CHRM3 P20309 1/20 0.39

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
SCHEMBL6378234 1.00 FDFT1 (0.53) FDFT1MMP13MMP2CHRM2CHRM4
SCHEMBL6383440 0.93 FDFT1 (0.53) FDFT1MMP13MMP2
SCHEMBL6377031 0.90 FDFT1 (0.51) FDFT1MMP13MMP2CHRM2CHRM3
SCHEMBL6376925 0.90 FDFT1 (0.51) FDFT1MMP13MMP2
SCHEMBL6377797 0.89 FDFT1 (0.51) FDFT1MMP13MMP2
SCHEMBL6377432 0.87 FDFT1 (0.50) FDFT1MMP13MMP2CHRM2CHRM4
SCHEMBL6379326 0.87 FDFT1 (0.50) FDFT1MMP13MMP2
SCHEMBL6378703 0.87 FDFT1 (0.50) FDFT1MMP13MMP2CHRM2CHRM4
SCHEMBL6382447 0.87 FDFT1 (0.51) FDFT1MMP13MMP2CHRM2CHRM3
SCHEMBL6380695 0.85 FDFT1 (0.64) FDFT1MMP13MMP2CHRM2CHRM4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1217001-B1 QUINUCLIDINE COMPOUNDS AND DRUGS CONTAINING THE SAME AS THE ACTIVE INGREDIENT EISAI CO LTD (JP) 2005-12-07 EP claimed
US-6599917-B1 A squalene-synthesizing enzyme inhibitor, a cholesterol biosynthesis inhibitor and a triglyceride biosynthesis inhibitor EISAI CO., LTD. (JP) 2003-07-29 US claimed
EP-1217001-A1 QUINUCLIDINE COMPOUNDS AND DRUGS CONTAINING THE SAME AS THE ACTIVE INGREDIENT Eisai Co., Ltd. (JP) 2002-06-26 EP claimed
EP-1217001-B1 QUINUCLIDINE COMPOUNDS AND DRUGS CONTAINING THE SAME AS THE ACTIVE INGREDIENT EISAI CO LTD (JP) 2005-12-07 EP disclosed
US-6599917-B1 A squalene-synthesizing enzyme inhibitor, a cholesterol biosynthesis inhibitor and a triglyceride biosynthesis inhibitor EISAI CO., LTD. (JP) 2003-07-29 US disclosed
EP-1217001-A1 QUINUCLIDINE COMPOUNDS AND DRUGS CONTAINING THE SAME AS THE ACTIVE INGREDIENT Eisai Co., Ltd. (JP) 2002-06-26 EP disclosed