SCHEMBL29904654

SCHEMBL29904654

CN1CCN(C2CCN(c3ccc(Nc4ncc(Cl)c(Nc5ccccc5S(=O)(=O)NC5CC5)n4)cc3F)CC2)CC1

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ EGFR P00533 11/20 0.63
▸ INSR P06213 5/20 0.58
▸ ALK Q9UM73 5/20 0.58
▸ IGF1R P08069 4/20 0.58
▸ BRD4 O60885 3/20 0.58
▸ FGFR3 P22607 4/20 0.56
▸ KDR P35968 3/20 0.56
▸ FGFR1 P11362 2/20 0.56
▸ FGFR2 P21802 2/20 0.56
▸ FGFR4 P22455 2/20 0.56
▸ BMPR1B O00238 1/20 0.56
▸ PLK4 O00444 1/20 0.56
▸ STK25 O00506 1/20 0.56
▸ RIOK3 O14730 1/20 0.56
▸ CHEK1 O14757 1/20 0.56
▸ CASK O14936 1/20 0.56
▸ AURKA O14965 1/20 0.56
▸ GAK O14976 1/20 0.56
▸ DCLK1 O15075 1/20 0.56
▸ MUSK O15146 1/20 0.56

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
SCHEMBL26906705 1.00 EGFR (0.63) EGFRINSRALKIGF1RBRD4
SCHEMBL26906554 0.87 EGFR (0.68) EGFRINSRALKIGF1RBRD4
SCHEMBL29904631 0.85 EGFR (0.64) EGFRINSRALKIGF1RBRD4
SCHEMBL21432432 0.84 EGFR (0.74) EGFRINSRALKIGF1RBRD4
SCHEMBL26906846 0.84 EGFR (0.67) EGFRINSRALKIGF1RBRD4
SCHEMBL26906878 0.83 ALK (0.73) EGFRINSRALKIGF1RFGFR3
SCHEMBL26906955 0.83 EGFR (0.61) EGFRINSRALKIGF1RBRD4
SCHEMBL24326980 0.82 EGFR (0.60) EGFRINSRALKIGF1RBRD4
SCHEMBL26906573 0.81 EGFR (0.61) EGFRINSRALKIGF1RBRD4
SCHEMBL26906909 0.80 EGFR (0.61) EGFRINSRALKIGF1RBRD4

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2022211573-A1 PYRIMIDINE DERIVATIVE HAVING PROTEIN KINASE INHIBITORY ACTIVITY, AND THERAPEUTIC PHARMACEUTICAL COMPOSITION COMPRISING SAME 주식회사 테라펙스 2022-10-06 — — WO claimed
WO-2022211573-A1 PYRIMIDINE DERIVATIVE HAVING PROTEIN KINASE INHIBITORY ACTIVITY, AND THERAPEUTIC PHARMACEUTICAL COMPOSITION COMPRISING SAME 주식회사 테라펙스 2022-10-06 — — WO disclosed
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