SCHEMBL14040742

SCHEMBL14040742

CCn1c(=O)c(-c2ccccc2)cc2cnc(Nc3ccc(OCCN)cc3)nc21

nearest known ligand 0.79

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
RIPK2 O43353 8/20 0.79
NOD2 Q9HC29 8/20 0.79
ACVR1 Q04771 6/20 0.79
FGFR1 P11362 4/20 0.61
EGFR P00533 2/20 0.59
SRC P12931 1/20 0.57
BTK Q06187 1/20 0.57
CDK4 P11802 2/20 0.54
CCND1 P24385 2/20 0.54
CCND2 P30279 2/20 0.54
CCND3 P30281 2/20 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
SCHEMBL20563559 0.88 RIPK2 (1.00) RIPK2NOD2ACVR1FGFR1SRC
SCHEMBL5762208 0.87 FGFR1 (0.75) RIPK2NOD2ACVR1FGFR1EGFR
SCHEMBL5764524 0.85 FGFR1 (0.72) RIPK2NOD2ACVR1FGFR1EGFR
SCHEMBL5763095 0.81 FGFR1 (0.70) RIPK2NOD2ACVR1FGFR1EGFR
SCHEMBL29498196 0.81 RIPK2 (1.00) RIPK2NOD2ACVR1FGFR1EGFR
SCHEMBL5762020 0.81 FGFR1 (0.68) RIPK2NOD2ACVR1FGFR1EGFR
SCHEMBL5761780 0.79 FGFR1 (0.70) RIPK2NOD2ACVR1FGFR1EGFR
SCHEMBL10192790 0.79 WEE1 (0.77) RIPK2NOD2ACVR1FGFR1EGFR
SCHEMBL20563994 0.78 RIPK2 (1.00) RIPK2NOD2ACVR1FGFR1EGFR
SCHEMBL5911585 0.77 FGFR1 (0.83) RIPK2NOD2ACVR1FGFR1EGFR

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-1975620-A2 Three hybrid assay system GPC Biotech AG (DE) 2008-10-01 EP disclosed