SCHEMBL26635201

SCHEMBL26635201

Cc1ccc(-c2cnc(C(F)(F)F)nc2)c(C=O)c1

nearest known ligand 0.39

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALOX5AP P20292 2/20 0.39
FEN1 P39748 2/20 0.39
SRC P12931 1/20 0.35
ALDH1A1 P00352 3/20 0.34
KDM4E B2RXH2 1/20 0.33
GAA P10253 1/20 0.33
ERN1 O75460 4/20 0.33
ELANE P08246 1/20 0.32
LMNA P02545 1/20 0.32
HDAC1 Q13547 2/20 0.32
PDE3B Q13370 2/20 0.31
PDE3A Q14432 2/20 0.31
KDM1A O60341 1/20 0.30
HDAC6 Q9UBN7 1/20 0.30
PDK2 Q15119 1/20 0.30

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
SCHEMBL30540196 1.00 ALOX5AP (0.39) ALOX5APFEN1SRCALDH1A1KDM4E
SCHEMBL26635226 0.85 ALOX5AP (0.43) ALOX5APFEN1ALDH1A1KDM4EERN1
SCHEMBL30540236 0.85 ALOX5AP (0.43) ALOX5APFEN1ALDH1A1KDM4EERN1
SCHEMBL30540206 0.84 ERN1 (0.41) ALOX5APFEN1ERN1
SCHEMBL26635272 0.84 ERN1 (0.41) ALOX5APFEN1ERN1
SCHEMBL30540254 0.84 FEN1 (0.54) ALOX5APFEN1ALDH1A1
SCHEMBL26635214 0.84 FEN1 (0.54) ALOX5APFEN1ALDH1A1
SCHEMBL30540244 0.82 XDH (0.46) ALOX5APFEN1ALDH1A1ERN1PDK2
SCHEMBL26635161 0.82 XDH (0.46) ALOX5APFEN1ALDH1A1ERN1PDK2
SCHEMBL30540245 0.81 KCNH2 (0.43) ALOX5APFEN1ERN1

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-2023208151-A1 USP INHIBITOR, PREPARATION METHOD THEREFOR, AND APPLICATION 北京华森英诺生物科技有限公司 2023-11-02 WO disclosed
CN-116621778-A USP inhibitor, preparation method and application thereof 北京华森英诺生物科技有限公司 2023-08-22 CN disclosed