SCHEMBL30993158

SCHEMBL30993158

CC(C)(C)OC(=O)N1CC=C(c2ccc3c(Cl)ccnc3c2)CC1

nearest known ligand 0.51

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ CNR1 P21554 2/20 0.51
▸ NAMPT P43490 1/20 0.48
▸ GRM1 Q13255 7/20 0.46
▸ GRM5 P41594 7/20 0.46
▸ WNT3A P56704 1/20 0.46
▸ CCNT1 O60563 1/20 0.46
▸ CDK9 P50750 1/20 0.46
▸ SOS1 Q07889 1/20 0.45
▸ LIPC P11150 1/20 0.45
▸ LIPG Q9Y5X9 1/20 0.45
▸ PDK4 Q16654 1/20 0.45
▸ CYP11B2 P19099 1/20 0.45
▸ CDK7 P50613 1/20 0.44
▸ CDK13 Q14004 1/20 0.44
▸ CDK12 Q9NYV4 1/20 0.44
▸ BRD4 O60885 1/20 0.44
▸ TNK2 Q07912 1/20 0.44

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
SCHEMBL30074970 0.92 CNR1 (0.55) CNR1NAMPTGRM1GRM5WNT3A
SCHEMBL1199869 0.85 NAMPT (0.53) CNR1NAMPTGRM1GRM5WNT3A
SCHEMBL31336142 0.83 GRM5 (0.51) CNR1NAMPTGRM1GRM5WNT3A
SCHEMBL8512618 0.83 GRM5 (0.51) CNR1NAMPTGRM1GRM5WNT3A
SCHEMBL25130586 0.83 CNR1 (0.52) CNR1GRM1GRM5CCNT1CDK9
SCHEMBL1868160 0.82 NAMPT (0.48) CNR1NAMPTGRM1GRM5WNT3A
SCHEMBL19701850 0.82 NAMPT (0.54) CNR1NAMPTGRM1GRM5WNT3A
SCHEMBL3195957 0.82 NAMPT (0.56) CNR1NAMPTGRM1GRM5PDK4
SCHEMBL19703157 0.81 NAMPT (0.53) CNR1NAMPTGRM1GRM5CDK9
SCHEMBL14857260 0.81 NAMPT (0.55) CNR1NAMPTGRM1GRM5SOS1

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-2024130095-A1 COMPOUNDS AND COMPOSITIONS AS CBP/P300 DEGRADERS AND USES THEREOF REGENTS OF THE UNIVERSITY OF MICHIGAN (US) 2024-06-20 — — WO disclosed
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