SCHEMBL30892154

SCHEMBL30892154

Nc1ncnc2c1c(-c1cnc(C(F)(F)F)nc1)cn2Cc1cnn(-c2ccc(F)cc2F)c1

nearest known ligand 0.47

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
CFTR P13569 16/20 0.47
RET P07949 1/20 0.39
RIPK2 O43353 2/20 0.37
SRC P12931 1/20 0.36

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
SCHEMBL20162850 1.00 CFTR (0.47) CFTRRETRIPK2SRC
SCHEMBL20162952 0.90 CFTR (0.57) CFTRRETSRC
SCHEMBL20162741 0.84 CFTR (0.47) CFTR
SCHEMBL20163056 0.83 CFTR (0.51) CFTR
SCHEMBL30037476 0.83 CFTR (0.51) CFTR
SCHEMBL20162991 0.83 CFTR (0.38) CFTR
SCHEMBL20173278 0.83 CFTR (0.38) CFTR
SCHEMBL20162993 0.83 CFTR (0.38) CFTR
SCHEMBL20162721 0.80 CFTR (0.53) CFTRRETSRC
SCHEMBL20162632 0.80 CFTR (0.61) CFTRSRC

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-3541390-B1 PYRROLOPYRIMIDINES AS CFTR POTENTIATORS CYSTIC FIBROSIS FOUND (US) 2024-05-01 EP disclosed