SCHEMBL20069657

SCHEMBL20069657

CC(I)N1CCC(C)(NC(=O)c2ncccc2Cl)CC1

nearest known ligand 0.51

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
RET P07949 19/20 0.51
PDE4A P27815 1/20 0.41
PDE4B Q07343 1/20 0.41
PDE4C Q08493 1/20 0.41
PDE4D Q08499 1/20 0.41

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
SCHEMBL20147610 0.91 RET (0.51) RETPDE4APDE4BPDE4CPDE4D
SCHEMBL20069109 0.86 RET (0.47) RETPDE4APDE4BPDE4CPDE4D
SCHEMBL20069794 0.84 RET (0.51) RETPDE4APDE4BPDE4CPDE4D
SCHEMBL20206019 0.81 RET (0.48) RETPDE4APDE4BPDE4CPDE4D
SCHEMBL24441504 0.79 RET (0.43) RET
SCHEMBL20147649 0.78 RET (0.41) RETPDE4APDE4BPDE4CPDE4D
SCHEMBL20147612 0.77 RET (0.45) RETPDE4APDE4BPDE4CPDE4D
SCHEMBL20147644 0.77 RET (0.42) RETPDE4APDE4BPDE4CPDE4D
SCHEMBL20147620 0.76 RET (0.46) RET
SCHEMBL20147642 0.76 RET (0.45) RET

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
WO-2018071454-A1 SUBSTITUTED PYRAZOLO[1,5-A]PYRIDINE COMPOUNDS AS RET KINASE INHIBITORS ANDREWS STEVEN W (US) 2018-04-19 WO disclosed