SCHEMBL29464352

SCHEMBL29464352

CC(=O)N1CCN(c2cccc(S(=O)(=O)Nc3ccc(C(F)(F)F)c(-c4cc(F)ccc4C)n3)n2)CC1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EIF2AK4 Q9P2K8 1/20 0.39
WDR5 P61964 1/20 0.37
WNT3A P56704 4/20 0.37
KDM4E B2RXH2 1/20 0.36
FAAH O00519 1/20 0.36
PIK3CB P42338 1/20 0.36
MTOR P42345 1/20 0.36
PIK3CG P48736 1/20 0.36
CCNT1 O60563 1/20 0.35
CCNA2 P20248 1/20 0.35
CDK2 P24941 1/20 0.35
CDK9 P50750 1/20 0.35
CNR2 P34972 1/20 0.34
MET P08581 1/20 0.34
KRAS P01116 2/20 0.34
ITGB2 P05107 2/20 0.34
ICAM1 P05362 2/20 0.34
ITGAL P20701 2/20 0.34
ACLY P53396 1/20 0.34
PIK3CA P42336 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
SCHEMBL19928736 1.00 EIF2AK4 (0.39) EIF2AK4WDR5WNT3AKDM4EFAAH
SCHEMBL19927706 0.90 WDR5 (0.37) WDR5KDM4ECCNA2CDK2MET
SCHEMBL19925113 0.89 WDR5 (0.35) WDR5KDM4EFAAHHSD11B1
SCHEMBL29464374 0.89 WDR5 (0.35) WDR5KDM4EFAAHHSD11B1
SCHEMBL19925371 0.88 ADRB2 (0.37) WDR5
SCHEMBL29464443 0.87 SCN1A (0.36) WDR5
SCHEMBL19925077 0.87 SCN1A (0.36) WDR5
Hydrochloric Acid SCHEMBL19925126 0.87 ADRB2 (0.38) WDR5MTOR
SCHEMBL23748046 0.87 WDR5 (0.35) WDR5KDM4EFAAH
SCHEMBL19925185 0.87 RORC (0.35) WDR5KDM4EFAAH

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
CN-109641873-B N- (pyridin-2-yl) pyridine-sulfonamide derivatives and their use for the treatment of disease 诺华股份有限公司 2022-03-18 CN claimed
CN-109641873-B N- (pyridin-2-yl) pyridine-sulfonamide derivatives and their use for the treatment of disease 诺华股份有限公司 2022-03-18 CN disclosed