SCHEMBL25374530

SCHEMBL25374530

NC(=O)c1ccccc1C12CC(C(F)(F)F)(C1)C2

nearest known ligand 0.49

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PDK2 Q15119 16/20 0.49
KDM4E B2RXH2 1/20 0.39
ALDH1A1 P00352 1/20 0.39
MAPT P10636 1/20 0.39
HPGD P15428 1/20 0.39
TSHR P16473 1/20 0.39
HSD17B10 Q99714 1/20 0.39
METAP2 P50579 1/20 0.37
BCAT2 O15382 1/20 0.36
NPC1 O15118 1/20 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
SCHEMBL25375801 0.77 BCAT2 (0.42) PDK2KDM4EALDH1A1MAPTHPGD
SCHEMBL22443382 0.77 PDK2 (0.51) PDK2KDM4EALDH1A1MAPTHPGD
SCHEMBL28197969 0.70 LMNA (0.47) KDM4EALDH1A1MAPTHPGDTSHR
SCHEMBL30293277 0.67 ALDH1A1 (0.54) KDM4EALDH1A1MAPTHPGDTSHR
SCHEMBL3840448 0.67 KDM4E (0.45) PDK2KDM4EALDH1A1MAPTHPGD
SCHEMBL11233815 0.66 METAP2 (0.39) PDK2KDM4EALDH1A1MAPTHPGD
SCHEMBL13128010 0.66 PDK2 (1.00) PDK2
SCHEMBL39118 0.65 ALDH1A1 (0.70) KDM4EALDH1A1MAPTHPGDTSHR
SCHEMBL4967588 0.65 ALDH1A1 (0.70) KDM4EALDH1A1MAPTHPGDTSHR
SCHEMBL27700719 0.65 ALDH1A1 (0.70) KDM4EALDH1A1MAPTHPGDTSHR

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
EP-3796975-B1 SULFONYLAMINOBENZAMIDE DERIVATIVES ORSOBIO INC (US) 2023-08-30 EP disclosed