SCHEMBL31623907

SCHEMBL31623907

Cc1nc(NC(=O)C(C)(C)C)ccc1C(F)(F)F

nearest known ligand 0.48

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
SORT1 Q99523 4/20 0.48
L3MBTL1 Q9Y468 1/20 0.42
ADORA1 P30542 2/20 0.40
CYP1A2 P05177 2/20 0.40
CYP2C9 P11712 2/20 0.40
CYP3A4 P08684 1/20 0.40
CYP2C19 P33261 1/20 0.40
KDR P35968 1/20 0.40
POLB P06746 1/20 0.38
ABL1 P00519 2/20 0.38
XPO1 O14980 3/20 0.37
HTR1F P30939 1/20 0.37
BCR P11274 1/20 0.36

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
SCHEMBL124461 0.81 GRM5 (0.47) SORT1L3MBTL1ADORA1CYP1A2CYP2C9
SCHEMBL759004 0.78 L3MBTL1 (0.44) SORT1L3MBTL1ADORA1CYP1A2CYP2C9
SCHEMBL3923726 0.78 RAB9A (0.56) L3MBTL1CYP1A2CYP2C9CYP3A4CYP2C19
SCHEMBL3923609 0.76 L3MBTL1 (0.43) L3MBTL1ADORA1CYP1A2CYP2C9CYP3A4
SCHEMBL3932619 0.75 L3MBTL1 (0.42) L3MBTL1ADORA1CYP1A2CYP2C9CYP3A4
SCHEMBL23974248 0.74 CYP1A2 (0.45) SORT1CYP1A2CYP2C9CYP3A4CYP2C19
SCHEMBL20880357 0.73 MAPT (0.53) SORT1L3MBTL1POLBXPO1
SCHEMBL12435247 0.72 KDM4E (0.44) SORT1L3MBTL1ADORA1CYP1A2POLB
SCHEMBL921576 0.72 L3MBTL1 (0.54) L3MBTL1ADORA1CYP1A2CYP2C9CYP3A4
SCHEMBL3923797 0.72 L3MBTL1 (0.39) L3MBTL1ADORA1CYP1A2CYP2C9CYP3A4

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
WO-2025128873-A1 HETEROCYCLIC PYRIDINONE COMPOUNDS AS TRIGGERING RECEPTOR EXPRESSED ON MYELOID CELLS 2 AGONISTS AND METHODS OF USE VIGIL NEUROSCIENCE, INC. (US) 2025-06-19 WO disclosed