SCHEMBL956896

SCHEMBL956896

Cn1cnnc1-c1cccc(NC(=O)c2ncccc2Cl)c1

nearest known ligand 0.65

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.65
GAA P10253 1/20 0.65
CLK1 P49759 1/20 0.57
SMN1; SMN2 Q16637 1/20 0.57
CBLB Q13191 11/20 0.49
BRD4 O60885 1/20 0.48
CREBBP Q92793 1/20 0.48
GRM1 Q13255 2/20 0.46
GRM4 Q14833 1/20 0.46
MAP3K5 Q99683 2/20 0.45

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
SCHEMBL952892 0.84 LMNA (0.64) LMNAGAACLK1SMN1; SMN2CBLB
SCHEMBL943582 0.82 LMNA (0.63) LMNAGAACLK1SMN1; SMN2CBLB
SCHEMBL944106 0.80 LMNA (0.60) LMNAGAACLK1SMN1; SMN2CBLB
SCHEMBL12857536 0.79 SMN1; SMN2 (0.64) LMNAGAACLK1SMN1; SMN2CBLB
SCHEMBL946100 0.78 LMNA (0.56) LMNAGAACLK1SMN1; SMN2CBLB
SCHEMBL14672846 0.78 LMNA (0.49) LMNAGAACLK1SMN1; SMN2CBLB
SCHEMBL17680694 0.78 SMN1; SMN2 (0.63) LMNAGAACLK1SMN1; SMN2CBLB
SCHEMBL22368582 0.77 LMNA (0.61) LMNAGAACLK1SMN1; SMN2CBLB
SCHEMBL14672844 0.77 LMNA (0.52) LMNAGAACLK1SMN1; SMN2CBLB
SCHEMBL945106 0.76 LMNA (0.56) LMNAGAACLK1SMN1; SMN2CBLB

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-2454250-A1 APOPTOSIS SIGNAL-REGULATING KINASE INHIBITORS Gilead Sciences, Inc. (US) 2012-05-23 EP disclosed
WO-2011008709-A1 APOPTOSIS SIGNAL-REGULATING KINASE INHIBITORS GILEAD SCIENCES, INC. (US) 2011-01-20 WO disclosed