SCHEMBL4789587

SCHEMBL4789587

Cc1ccc(NC(=O)c2cc(N3CCC(O)CC3)cc(C(F)(F)F)c2)cc1NC(=O)c1cnc2[nH]ccc2c1

nearest known ligand 0.68

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CSF1R P07333 10/20 0.68
ABL1 P00519 2/20 0.57
BRAF P15056 6/20 0.56
LYN P07948 2/20 0.56
RAF1 P04049 1/20 0.56
EGFR P00533 2/20 0.55
TNK2 Q07912 1/20 0.52
MAP4K2 Q12851 1/20 0.52
MAPK14 Q16539 1/20 0.50
KDM4E B2RXH2 1/20 0.49
POLB P06746 1/20 0.49
RECQL P46063 1/20 0.49
KIT P10721 2/20 0.47

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
SCHEMBL4789584 0.92 CSF1R (0.57) CSF1RABL1BRAFLYNRAF1
SCHEMBL4788129 0.92 BRAF (0.67) CSF1RABL1BRAFLYNRAF1
SCHEMBL4789210 0.89 BRAF (0.59) CSF1RABL1BRAFLYNRAF1
SCHEMBL4789368 0.88 BRAF (0.60) CSF1RABL1BRAFLYNRAF1
SCHEMBL14026977 0.86 CSF1R (0.53) CSF1RABL1BRAFLYNRAF1
SCHEMBL4788638 0.84 CSF1R (0.69) CSF1RABL1BRAFLYNRAF1
SCHEMBL4788124 0.83 ABL1 (0.59) CSF1RABL1BRAFLYNRAF1
SCHEMBL4789348 0.82 CSF1R (0.68) CSF1RABL1BRAFLYNRAF1
SCHEMBL4789207 0.81 ABL1 (0.55) CSF1RABL1BRAFLYNRAF1
SCHEMBL4787038 0.81 BRAF (0.74) CSF1RABL1BRAFRAF1EGFR

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
WO-2008144253-A1 PROTEIN KINASE INHIBITORS AND METHODS FOR USING THEREOF IRM LLC (BM) 2008-11-27 WO claimed
WO-2008144253-A1 PROTEIN KINASE INHIBITORS AND METHODS FOR USING THEREOF IRM LLC (BM) 2008-11-27 WO disclosed