SCHEMBL20008423

SCHEMBL20008423

C=CCCN(CCC)c1nc(-c2cc(NC)cnc2C)cnc1N

nearest known ligand 0.34

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
CRHR1 P34998 1/20 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
SCHEMBL20008162 0.76 CRHR1 (0.35) CRHR1
SCHEMBL20008752 0.73 CRHR1 (0.33) CRHR1
SCHEMBL20008148 0.72 CRHR1 (0.32) CRHR1
SCHEMBL20008333 0.72 RAF1 (0.32) CRHR1
SCHEMBL20008353 0.71 CRHR1 (0.32) CRHR1
SCHEMBL20009334 0.67
SCHEMBL20008458 0.67 CRHR1 (0.31) CRHR1
SCHEMBL20008141 0.63 BRAF (0.31) CRHR1
SCHEMBL20008703 0.62 CRHR1 (0.35) CRHR1
SCHEMBL20008772 0.62 BRAF (0.31)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3299367-A1 BIARYL AMIDE COMPOUNDS AS KINASE INHIBITORS Novartis AG (CH) 2018-03-28 EP disclosed