SCHEMBL24935779

SCHEMBL24935779

CC(=O)COCC(F)C(F)COc1ccc(N)c(C(F)(F)F)c1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AR P10275 1/20 0.36
MAOB P27338 2/20 0.35
MAOA P21397 1/20 0.35
FFAR4 Q5NUL3 2/20 0.35
HPGD P15428 2/20 0.34
KDM4E B2RXH2 3/20 0.33
PPARD Q03181 1/20 0.33
KMT2A Q03164 1/20 0.33
PDK2 Q15119 1/20 0.33
MRGPRX4 Q96LA9 1/20 0.33
AGER Q15109 1/20 0.33
PPARG P37231 1/20 0.33
PPARA Q07869 1/20 0.33
ALDH1A1 P00352 1/20 0.33
CYP1A2 P05177 1/20 0.33
CYP2C9 P11712 1/20 0.33
CYP2C19 P33261 1/20 0.33
RAB9A P51151 1/20 0.33
SCN9A Q15858 1/20 0.32
EPHX2 P34913 2/20 0.32

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
SCHEMBL24935232 0.87 PPARD (0.38) MAOBMAOAHPGDKDM4EPPARD
SCHEMBL185552 0.76 MGLL (0.39) ARMAOBFFAR4KDM4EKMT2A
SCHEMBL24935694 0.75 L3MBTL1 (0.42) MAOBHPGDKMT2ACYP1A2CYP2C9
SCHEMBL10352869 0.75 PDK2 (0.44) ARMAOAFFAR4HPGDKDM4E
SCHEMBL25063751 0.74 S1PR1 (0.36) ARMAOBMAOAHPGDKDM4E
SCHEMBL24935608 0.72 PPARG (0.36) MAOBMAOAHPGDKDM4EPPARD
SCHEMBL2746368 0.72 PDE3B (0.42) ARMAOBMAOAFFAR4HPGD
SCHEMBL10352551 0.71 FFAR1 (0.38) ARFFAR4KMT2APDK2CYP2C9
SCHEMBL5453278 0.71 MAPK1 (0.47) ARMAOBMAOAKMT2ACYP2C9
SCHEMBL2746558 0.71 KDM4E (0.50) HPGDKDM4EKMT2APPARGPPARA

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-4119546-A1 BIFUNCTIONAL COMPOUND, PREPARATION METHOD THEREFOR, AND USE THEREOF Suzhou Kintor Pharmaceuticals, Inc. (CN) 2023-01-18 EP disclosed