SCHEMBL4861094

SCHEMBL4861094

CNc1c(C(=O)Nc2cc(NC(=O)c3ccc(C(C)(C)C)s3)ccc2C)cnc2[nH]ccc12

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDR P35968 3/20 0.42
▸ SRC P12931 2/20 0.42
▸ INSR P06213 1/20 0.42
▸ LCK P06239 1/20 0.42
▸ LYN P07948 1/20 0.42
▸ HCK P08631 1/20 0.42
▸ NPC1 O15118 2/20 0.41
▸ RAB9A P51151 2/20 0.41
▸ RXFP1 Q9HBX9 1/20 0.41
▸ BRAF P15056 11/20 0.39
▸ MEN1 O00255 1/20 0.37
▸ KMT2A Q03164 1/20 0.37
▸ LMNA P02545 1/20 0.36
▸ HTT P42858 1/20 0.36
▸ L3MBTL1 Q9Y468 1/20 0.36
▸ RAF1 P04049 1/20 0.36
▸ ARAF P10398 1/20 0.36
▸ ABL1 P00519 3/20 0.36
▸ HDAC3 O15379 2/20 0.36
▸ PDGFRB P09619 2/20 0.36

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
SCHEMBL4788672 0.81 LMNA (0.50) KDRSRCNPC1RAB9ABRAF
SCHEMBL4867903 0.81 BRAF (0.53) KDRSRCINSRLCKLYN
SCHEMBL4861442 0.81 BRAF (0.41) KDRSRCLYNBRAFRAF1
SCHEMBL4788647 0.80 LCK (0.46) KDRSRCLCKBRAFKMT2A
SCHEMBL4789788 0.79 BMX (0.46) KDRSRCNPC1RAB9ARXFP1
SCHEMBL4789714 0.79 BRAF (0.48) KDRSRCRXFP1BRAFKMT2A
SCHEMBL4849666 0.79 NPC1 (0.46) SRCNPC1RAB9ABRAFRAF1
SCHEMBL4788857 0.78 BRAF (0.52) KDRSRCLCKBRAFKMT2A
SCHEMBL4788095 0.78 BRAF (0.63) KDRLCKBRAFRAF1ARAF
SCHEMBL14027871 0.78 JAK1 (0.42) BRAF

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 3 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
WO-2008144253-A1 PROTEIN KINASE INHIBITORS AND METHODS FOR USING THEREOF IRM LLC (BM) 2008-11-27 — — WO disclosed
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