SCHEMBL3146461

SCHEMBL3146461

CNC1(COc2cncc(-c3ccc(OC)c(OC)c3OC)c2)CC1

nearest known ligand 0.52

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
FPR2 P25090 3/20 0.39
CYP11B1 P15538 2/20 0.34
CYP11B2 P19099 2/20 0.34

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
Hydrochloric Acid SCHEMBL3767824 0.99 FPR2 (0.39) FPR2CYP11B1CYP11B2
SCHEMBL3258733 0.89 FPR2 (0.40) FPR2CYP11B1CYP11B2
SCHEMBL3150832 0.84 ACVR1B (0.40) CYP11B1CYP11B2
Hydrochloric Acid SCHEMBL3770830 0.83 FPR2 (0.39) FPR2
Hydrochloric Acid SCHEMBL3774439 0.83 ACVR1B (0.39) CYP11B1CYP11B2
SCHEMBL4627064 0.80 FPR2 (0.39) FPR2CYP11B1CYP11B2
SCHEMBL3151157 0.79 CHRNB1 (0.49) CYP11B1CYP11B2
Hydrochloric Acid SCHEMBL3147131 0.78 CHRNB1 (0.48) CYP11B1CYP11B2
SCHEMBL3155856 0.77 FPR2 (0.38) FPR2
SCHEMBL3150645 0.77 CYP11B1 (0.47) CYP11B1CYP11B2

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
EP-1979321-B9 NOVEL PYRIDINYLAMINOALKYLENE- AND PYRIDINYLOXYALKYLENE-CYCLOPROPANAMINES, PROCESS FOR THE PREPARATION THEREOF AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM SERVIER LAB (FR) 2010-02-17 EP disclosed
EP-1979321-B1 NOVEL PYRIDINYLAMINOALKYLENE- AND PYRIDINYLOXYALKYLENE-CYCLOPROPANAMINES, PROCESS FOR THE PREPARATION THEREOF AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM SERVIER LAB (FR) 2009-07-29 EP disclosed