SCHEMBL14981287

SCHEMBL14981287

CCOc1cc(C(=O)N2CCN(C)CC2)ccc1Nc1ncc(Cl)c(Nc2ccccc2C)n1

nearest known ligand 0.65

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ LRRK2 Q5S007 14/20 0.65
▸ ALK Q9UM73 3/20 0.57
▸ AXL P30530 2/20 0.56
▸ INSR P06213 1/20 0.54
▸ IGF1R P08069 1/20 0.54
▸ MAP3K9 P80192 1/20 0.54
▸ MKNK2 Q9HBH9 1/20 0.54
▸ CCNK O75909 1/20 0.54
▸ CCNA2 P20248 1/20 0.54
▸ CDK2 P24941 1/20 0.54
▸ CCND3 P30281 1/20 0.54
▸ CDK9 P50750 1/20 0.54
▸ CDK6 Q00534 1/20 0.54

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
SCHEMBL14981326 0.91 LRRK2 (0.79) LRRK2MAP3K9MKNK2
SCHEMBL10208085 0.88 LRRK2 (0.62) LRRK2ALKINSRIGF1RMAP3K9
SCHEMBL1911990 0.87 ALK (0.68) LRRK2ALKAXLINSRIGF1R
SCHEMBL10208739 0.85 ZAP70 (0.59) LRRK2ALKINSRIGF1R
SCHEMBL1911966 0.82 ALK (0.62) LRRK2ALKINSRIGF1RMAP3K9
SCHEMBL17244676 0.81 ALK (0.57) LRRK2ALKAXLINSRIGF1R
SCHEMBL1911944 0.80 LRRK2 (0.74) LRRK2ALKINSRIGF1RMAP3K9
SCHEMBL1911954 0.80 LRRK2 (0.65) LRRK2ALKAXLINSRIGF1R
SCHEMBL1912025 0.80 LRRK2 (0.75) LRRK2MAP3K9MKNK2
SCHEMBL14556271 0.80 LRRK2 (0.86) LRRK2MAP3K9MKNK2

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-2287156-B1 2,4-Di(phenylamino)-pyrimidines useful in the treatment of neoplastic diseases, inflammatory and immune system disorders NOVARTIS AG (CH) 2013-05-29 — — EP disclosed
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