SCHEMBL4074688

SCHEMBL4074688

COC(=O)c1cc(Nc2cc(C3CC3)n[nH]2)nc(N[C@@H](CO)c2ccc(F)cc2)n1

nearest known ligand 0.46

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
NTRK1 P04629 14/20 0.46
IGF1R P08069 1/20 0.41
MAPK1 P28482 3/20 0.38
CCNT1 O60563 2/20 0.37
CDK9 P50750 2/20 0.37
CDK2 P24941 1/20 0.37

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
SCHEMBL4069131 0.90 IGF1R (0.45) NTRK1IGF1RMAPK1CCNT1CDK9
SCHEMBL4072748 0.89 NTRK1 (0.47) NTRK1MAPK1
SCHEMBL4151801 0.85 NTRK1 (0.59) NTRK1IGF1R
SCHEMBL4066820 0.83 NTRK1 (0.47) NTRK1
SCHEMBL4077780 0.80 NTRK1 (0.56) NTRK1IGF1R
SCHEMBL4073723 0.77 NTRK1 (0.53) NTRK1
SCHEMBL3343540 0.77 NTRK1 (0.54) NTRK1CCNT1CDK9
SCHEMBL4148218 0.76 IGF1R (0.58) NTRK1IGF1R
SCHEMBL4068820 0.76 NTRK1 (0.54) NTRK1
SCHEMBL4069692 0.76 NTRK1 (0.51) NTRK1

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-1686999-B1 PYRAZOLE DERIVATIVES AS INHIBITORS OF RECEPTOR TYROSINE KINASES ASTRAZENECA AB (SE) 2009-07-01 EP disclosed