SCHEMBL8024790

SCHEMBL8024790

CCC(Nc1ncnc(C(C)F)c1Cl)c1ccc(C)cc1

nearest known ligand 0.39

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.38
ALDH1A1 P00352 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
EGFR P00533 4/20 0.38
P2RX3 P56373 2/20 0.38
RPS6KB1 P23443 5/20 0.37
AURKA O14965 1/20 0.37
AKT1 P31749 2/20 0.35

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
SCHEMBL8024896 0.90 HDAC6 (0.41) EGFRRPS6KB1AURKA
SCHEMBL8026454 0.89 EGFR (0.42) LMNASMN1; SMN2EGFRRPS6KB1AKT1
SCHEMBL8024728 0.88 EGFR (0.49) LMNAEGFRP2RX3RPS6KB1
SCHEMBL8014465 0.86 EGFR (0.36) EGFRRPS6KB1AKT1
SCHEMBL8025137 0.85 EGFR (0.37) EGFRRPS6KB1AKT1
SCHEMBL8014444 0.84 SCN1A (0.36) ALDH1A1EGFRRPS6KB1AKT1
SCHEMBL8026446 0.84 EGFR (0.35) LMNAEGFRRPS6KB1AKT1
SCHEMBL11289908 0.84 LMNA (0.41) LMNAALDH1A1SMN1; SMN2EGFRP2RX3
SCHEMBL8014470 0.78 CXCR1 (0.33) EGFR
SCHEMBL11282132 0.76 AKT1 (0.44) LMNASMN1; SMN2EGFRP2RX3RPS6KB1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0543402-B1 Aralkylaminopyrimidine derivative, method for preparing the same and composition for controlling noxious organisms UBE INDUSTRIES (JP) 2000-03-01 EP claimed
US-5280025-A Aralkylaminopyrimidine derivative, and chemical for controlling noxious organisms containing the same UBE INDUSTRIES, LTD. (JP) 1994-01-18 US claimed
EP-0543402-A1 Aralkylaminopyrimidine derivative, method for preparing the same and chemical for controlling noxious organisms containing the same UBE INDUSTRIES, LTD. (JP) 1993-05-26 EP claimed