SCHEMBL8014444

SCHEMBL8014444

CCC(Nc1ncnc(C(C)F)c1Cl)c1ccc(S(=O)(=O)CC)cc1

nearest known ligand 0.36

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
SCN1A P35498 5/20 0.36
SCN5A Q14524 5/20 0.36
SCN8A Q9UQD0 5/20 0.36
RPS6KB1 P23443 4/20 0.35
EGFR P00533 2/20 0.35
AKT1 P31749 2/20 0.34
SCN1B Q07699 2/20 0.34
KDM4E B2RXH2 1/20 0.34
MEN1 O00255 1/20 0.34
ALDH1A1 P00352 1/20 0.34
MAPT P10636 1/20 0.34
HPGD P15428 1/20 0.34
KMT2A Q03164 1/20 0.34
APOBEC3G Q9HC16 1/20 0.34

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
SCHEMBL8024904 0.88 RORC (0.37) EGFRKDM4EMEN1ALDH1A1MAPT
SCHEMBL8024896 0.84 HDAC6 (0.41) RPS6KB1EGFRMEN1KMT2A
SCHEMBL8024790 0.84 LMNA (0.38) RPS6KB1EGFRAKT1ALDH1A1
SCHEMBL8026454 0.83 EGFR (0.42) RPS6KB1EGFRAKT1
SCHEMBL8024728 0.83 EGFR (0.49) RPS6KB1EGFRKDM4E
SCHEMBL8026446 0.82 EGFR (0.35) RPS6KB1EGFRAKT1
SCHEMBL8014465 0.81 EGFR (0.36) RPS6KB1EGFRAKT1
SCHEMBL8014577 0.81 CNR1 (0.39) EGFRKDM4EALDH1A1HPGD
SCHEMBL8025137 0.81 EGFR (0.37) RPS6KB1EGFRAKT1MEN1KMT2A
SCHEMBL8014530 0.79 EGFR (0.34) EGFRMEN1KMT2A

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