SCHEMBL24615840

SCHEMBL24615840

COCC1(C(F)(F)F)CN(C(C)=O)C1

nearest known ligand 0.41

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.41
USP2 O75604 3/20 0.32
HPGD P15428 1/20 0.32
CYP1A2 P05177 2/20 0.32
CYP2C19 P33261 2/20 0.32
CYP2C9 P11712 1/20 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
SCHEMBL24615958 0.84 SMN1; SMN2 (0.40) SMN1; SMN2USP2HPGD
SCHEMBL30327046 0.77 SMN1; SMN2 (0.39) SMN1; SMN2USP2HPGDCYP1A2
SCHEMBL24615831 0.75 SMN1; SMN2 (0.45) SMN1; SMN2CYP1A2
SCHEMBL23536294 0.74 CYP2D6 (0.34) USP2CYP1A2CYP2C19CYP2C9
SCHEMBL19014335 0.71 SMN1; SMN2 (0.45) SMN1; SMN2USP2HPGDCYP1A2CYP2C19
SCHEMBL17815708 0.71 SCN9A (0.32)
SCHEMBL23536071 0.70 USP2 (0.45) SMN1; SMN2USP2HPGD
SCHEMBL24615832 0.69 SMN1; SMN2 (0.36) SMN1; SMN2
SCHEMBL30548544 0.68 SMN1; SMN2 (0.50) SMN1; SMN2USP2HPGDCYP1A2CYP2C19
SCHEMBL14970391 0.67 SMN1; SMN2 (0.50) SMN1; SMN2USP2HPGDCYP1A2CYP2C19

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-2022148422-A1 BRIDGED COMPOUNDS AS KRAS G12D INHIBITOR AND DEGRADER AND THE USE THEREOF BEIGENE, LTD. (KY) 2022-07-14 WO disclosed