SCHEMBL31542289

SCHEMBL31542289

Cc1cc2c(N3CCN(C)c4ccc(C#N)cc43)nc(C3=CCN(C(=O)OC(C)(C)C)CC3)cc2n(C)c1=O

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ GRM1 Q13255 11/20 0.41
▸ GRM5 P41594 10/20 0.41
▸ ELANE P08246 4/20 0.39
▸ GABRP O00591 1/20 0.37
▸ GABRD O14764 1/20 0.37
▸ GABRA1 P14867 1/20 0.37
▸ GABRB1 P18505 1/20 0.37
▸ GABRG2 P18507 1/20 0.37
▸ GABRB3 P28472 1/20 0.37
▸ GABRA5 P31644 1/20 0.37
▸ GABRA3 P34903 1/20 0.37
▸ GABRA2 P47869 1/20 0.37
▸ GABRB2 P47870 1/20 0.37
▸ GABRA4 P48169 1/20 0.37
▸ GABRE P78334 1/20 0.37
▸ GABRA6 Q16445 1/20 0.37
▸ GABRG1 Q8N1C3 1/20 0.37
▸ GABRG3 Q99928 1/20 0.37
▸ GABRQ Q9UN88 1/20 0.37
▸ KDM1A O60341 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
SCHEMBL31542274 0.86 ELANE (0.42) GRM1GRM5ELANEGABRPGABRD
SCHEMBL31542300 0.83 GPR119 (0.41) —
SCHEMBL31542332 0.76 EGLN2 (0.44) —
SCHEMBL31542350 0.75 GPR119 (0.40) —
SCHEMBL31542269 0.75 BRPF1 (0.36) GABRA1GABRG2GABRB3GABRA5GABRA3
SCHEMBL31542288 0.72 TLR9 (0.35) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL26548555 0.71 MAPT (0.37) GABRA1GABRG2GABRB3GABRA5GABRA3
SCHEMBL31542292 0.70 NOTCH1 (0.36) —
SCHEMBL5320102 0.70 PDK4 (0.53) GRM1GRM5ELANEGABRPGABRD
SCHEMBL31542279 0.69 BRPF1 (0.35) GABRA1GABRG2GABRB3GABRA5GABRA3

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-2025062330-A1 HETEROCYCLIC COMPOUNDS AS CBP SELECTIVE DEGRADERS AURIGENE ONCOLOGY LIMITED (IN) 2025-03-27 — — WO disclosed
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