SCHEMBL541318

SCHEMBL541318

CCn1cc(-c2cccc(OC)c2)c2cc(CN[C@H](C)c3ccccc3)ccc21

nearest known ligand 0.53

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CASR P41180 15/20 0.53
BRD4 O60885 1/20 0.41
PPARG P37231 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.38
DGAT2 Q96PD7 1/20 0.38

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
SCHEMBL541682 0.95 CASR (0.57) CASRBRD4PPARG
SCHEMBL541683 0.95 CASR (0.57) CASRBRD4PPARG
SCHEMBL541459 0.90 CASR (0.48) CASRPPARG
SCHEMBL541458 0.90 CASR (0.48) CASRPPARG
SCHEMBL541461 0.89 CASR (0.47) CASRSMN1; SMN2
SCHEMBL541235 0.89 CASR (0.47) CASRSMN1; SMN2
SCHEMBL541227 0.87 CASR (0.58) CASRPPARGSMN1; SMN2
SCHEMBL541477 0.87 CASR (0.58) CASRPPARGSMN1; SMN2
SCHEMBL541398 0.87 CASR (0.43) CASRBRD4PPARG
SCHEMBL541388 0.87 CASR (0.43) CASRBRD4PPARG

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-1509518-B1 CALCIUM RECEPTOR MODULATING AGENTS AMGEN INC (US) 2012-02-08 EP claimed
US-7176322-B2 Calcium receptor modulating agents AMGEN INC. (US) 2007-02-13 US claimed
EP-1509518-B1 CALCIUM RECEPTOR MODULATING AGENTS AMGEN INC (US) 2012-02-08 EP disclosed
EP-1509518-B1 CALCIUM RECEPTOR MODULATING AGENTS AMGEN INC (US) 2012-02-08 EP disclosed
US-7176322-B2 Calcium receptor modulating agents AMGEN INC. (US) 2007-02-13 US disclosed
US-7176322-B2 Calcium receptor modulating agents AMGEN INC. (US) 2007-02-13 US disclosed