SCHEMBL13261092

SCHEMBL13261092

Cc1cc2cc(NCc3cc(NC(=O)c4ccc(CN5CCN(C)CC5)cc4)ccc3C)cnc2[nH]1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ABL1 P00519 11/20 0.53
▸ LCK P06239 5/20 0.52
▸ CSF1R P07333 5/20 0.52
▸ EGFR P00533 4/20 0.52
▸ MAPK14 Q16539 3/20 0.52
▸ KDR P35968 2/20 0.52
▸ ERBB4 Q15303 1/20 0.52
▸ KIT P10721 9/20 0.50
▸ BCR P11274 5/20 0.50
▸ DDR2 Q16832 3/20 0.50
▸ RET P07949 1/20 0.50
▸ ABL2 P42684 5/20 0.49
▸ PDGFRA P16234 3/20 0.49
▸ ERBB2 P04626 2/20 0.49
▸ FYN P06241 2/20 0.49
▸ LYN P07948 2/20 0.49
▸ PDGFRB P09619 2/20 0.49
▸ FGR P09769 2/20 0.49
▸ SRC P12931 2/20 0.49
▸ BRAF P15056 2/20 0.49

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
SCHEMBL15859835 0.92 ABL1 (0.51) ABL1LCKCSF1REGFRMAPK14
SCHEMBL15859886 0.91 ABL1 (0.51) ABL1LCKCSF1REGFRMAPK14
SCHEMBL15859833 0.91 ABL1 (0.50) ABL1LCKCSF1REGFRMAPK14
SCHEMBL3808468 0.90 ABL1 (0.58) ABL1LCKCSF1REGFRMAPK14
SCHEMBL28036042 0.85 ABL1 (0.49) ABL1LCKCSF1REGFRMAPK14
SCHEMBL13261072 0.83 IKBKE (0.44) ABL1LCKCSF1REGFRMAPK14
SCHEMBL15860017 0.83 BRAF (0.49) ABL1LCKEGFRKITBCR
SCHEMBL15859869 0.82 KIT (0.53) ABL1LCKEGFRKITBCR
SCHEMBL15860018 0.82 ABL1 (0.57) ABL1LCKEGFRKITBCR
SCHEMBL15859946 0.81 ABL1 (0.51) ABL1LCKCSF1REGFRMAPK14

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-2396325-B1 DERIVATIVES OF AZAINDOLES AS INHIBITORS OF PROTEIN KINASES ABL AND SRC ORIBASE PHARMA (FR) 2015-04-01 — — EP disclosed
WO-2010092489-A1 DERIVATIVES OF AZAINDOLES AS INHIBITORS OF PROTEIN KINASES ABL AND SRC NOVA DECISION (FR) 2010-08-19 — — WO disclosed
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