SCHEMBL20181850

SCHEMBL20181850

C#CC(C1CC1)n1cc(C)c2c(Cl)ncnc21

nearest known ligand 0.39

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
ADK P55263 1/20 0.39
MEN1 O00255 1/20 0.30
NR2F2 P24468 1/20 0.30
KMT2A Q03164 1/20 0.30

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
SCHEMBL20162624 0.85 ADK (0.39) ADK
SCHEMBL20182185 0.85 RET (0.41) ADK
SCHEMBL20182341 0.80 ADK (0.40) ADKMEN1NR2F2KMT2A
SCHEMBL20182230 0.76 ADK (0.38) ADKMEN1NR2F2KMT2A
SCHEMBL25611698 0.74 ADK (0.45) ADKMEN1NR2F2KMT2A
SCHEMBL20163009 0.72 MTOR (0.42) ADK
SCHEMBL20351622 0.69 ADK (0.56) ADK
SCHEMBL20181888 0.67 ADK (0.44) ADKMEN1NR2F2KMT2A
SCHEMBL19264034 0.67 ADK (0.53) ADK
SCHEMBL20351756 0.67 ADK (0.53) ADKMEN1KMT2A

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-2018094137-A1 PYRROLOPYRIMIDINES AS CFTR POTENTIATORS CYSTIC FIBROSIS FOUNDATION THERAPEUTICS INC. (US) 2018-05-24 WO disclosed