SCHEMBL24255898

SCHEMBL24255898

COc1cc(N2CCN(C)CC2)ccc1Nc1ncc(Cl)c(Nc2ccc(NS(C)(=O)=O)cc2)n1

nearest known ligand 0.80

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ EGFR P00533 8/20 0.80
▸ ALK Q9UM73 8/20 0.70
▸ INSR P06213 3/20 0.67
▸ IGF1R P08069 3/20 0.67
▸ LRRK2 Q5S007 1/20 0.66
▸ BRD4 O60885 4/20 0.65

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
SCHEMBL24256003 0.91 EGFR (0.69) EGFRALKINSRIGF1RBRD4
SCHEMBL21847015 0.89 EGFR (1.00) EGFRALKINSRIGF1RLRRK2
SCHEMBL29609251 0.89 EGFR (1.00) EGFRALKINSRIGF1RLRRK2
SCHEMBL26906790 0.83 EGFR (0.75) EGFRALKINSRIGF1RLRRK2
SCHEMBL29904639 0.83 EGFR (0.75) EGFRALKINSRIGF1RLRRK2
SCHEMBL20398846 0.83 ALK (0.75) EGFRALKINSRIGF1RBRD4
SCHEMBL22087018 0.83 EGFR (0.87) EGFRALKINSRIGF1RLRRK2
SCHEMBL16752896 0.83 ALK (1.00) EGFRALKINSRIGF1RLRRK2
SCHEMBL21847017 0.82 EGFR (1.00) EGFRALKINSRIGF1RLRRK2
SCHEMBL21846986 0.82 EGFR (1.00) EGFRALKINSRIGF1RLRRK2

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-2022036313-A1 PYRIMIDINYL SULFONAMIDES AS INHIBITORS OF ACK1/TNK1 TYROSINE KINASE H. LEE MOFFITT CANCER CENTER AND RESEARCH INSTITUTE, INC. (US) 2022-02-17 — — WO disclosed
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