SCHEMBL24935148

SCHEMBL24935148

CC(=O)COCC(F)(F)CCOc1ccc(C)cc1

nearest known ligand 0.45

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.45
PPARA Q07869 1/20 0.41
NPC1 O15118 2/20 0.40
CYP1A2 P05177 1/20 0.40
CYP3A4 P08684 1/20 0.40
CYP2C9 P11712 1/20 0.40
CYP2C19 P33261 1/20 0.40
HDAC1 Q13547 1/20 0.40
HDAC2 Q92769 1/20 0.40
MEN1 O00255 3/20 0.40
KMT2A Q03164 3/20 0.40
MAPT P10636 1/20 0.39
HPGD P15428 1/20 0.39
MAOB P27338 1/20 0.38
LMNA P02545 1/20 0.38
GAA P10253 1/20 0.38

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
SCHEMBL24935781 0.81 MRGPRX4 (0.41) L3MBTL1PPARACYP1A2CYP2C9MAPT
SCHEMBL19599651 0.79 L3MBTL1 (0.56) L3MBTL1NPC1MEN1KMT2AMAPT
SCHEMBL24935555 0.77 L3MBTL1 (0.54) L3MBTL1NPC1HDAC1HDAC2MEN1
SCHEMBL18495410 0.75 L3MBTL1 (0.51) L3MBTL1NPC1MEN1KMT2AMAPT
SCHEMBL17174025 0.75 L3MBTL1 (0.51) L3MBTL1NPC1HDAC1HDAC2MEN1
SCHEMBL8234368 0.73 MAPT (0.59) L3MBTL1NPC1HDAC1MEN1KMT2A
SCHEMBL24935607 0.73 MRGPRX4 (0.41) PPARACYP1A2CYP2C9HPGD
SCHEMBL24935554 0.72 MEN1 (0.46) L3MBTL1PPARANPC1MEN1KMT2A
SCHEMBL24935009 0.72 PPARD (0.37) CYP1A2CYP2C9CYP2C19HPGD
SCHEMBL15004510 0.71 DRD2 (0.50) L3MBTL1PPARANPC1HPGD

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