SCHEMBL30178579

SCHEMBL30178579

CC(C)(C)OC(=O)N1CC=C(c2ccc3[nH]c4nnc(Cl)cc4c3c2)CC1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CNR1 P21554 1/20 0.51
▸ NAMPT P43490 1/20 0.47
▸ SOS1 Q07889 1/20 0.46
▸ CDK7 P50613 1/20 0.45
▸ CDK13 Q14004 1/20 0.45
▸ CDK12 Q9NYV4 1/20 0.45
▸ GRM1 Q13255 8/20 0.45
▸ GRM5 P41594 7/20 0.45
▸ JAK1 P23458 1/20 0.44
▸ CDK9 P50750 3/20 0.43
▸ CCNT1 O60563 1/20 0.43
▸ GABRP O00591 1/20 0.42
▸ GABRD O14764 1/20 0.42
▸ GABRA1 P14867 1/20 0.42
▸ GABRB1 P18505 1/20 0.42
▸ GABRG2 P18507 1/20 0.42
▸ GABRB3 P28472 1/20 0.42
▸ GABRA5 P31644 1/20 0.42
▸ GABRA3 P34903 1/20 0.42
▸ GABRA2 P47869 1/20 0.42

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
SCHEMBL30178737 0.85 NAMPT (0.47) CNR1NAMPTSOS1CDK7CDK13
SCHEMBL23580367 0.85 NAMPT (0.47) CNR1NAMPTSOS1CDK7CDK13
SCHEMBL30273978 0.83 CNR1 (0.54) CNR1NAMPTCDK7CDK13CDK12
SCHEMBL25036987 0.83 CNR1 (0.54) CNR1NAMPTCDK7CDK13CDK12
SCHEMBL31692148 0.83 CDK9 (0.51) CNR1NAMPTSOS1CDK7CDK13
SCHEMBL23166169 0.81 CNR1 (0.52) CNR1NAMPTSOS1CDK7CDK13
SCHEMBL29760278 0.81 CNR1 (0.52) CNR1NAMPTSOS1CDK7CDK13
SCHEMBL31017627 0.79 CNR1 (0.48) CNR1NAMPTSOS1CDK7CDK13
SCHEMBL30484043 0.79 CNR1 (0.48) CNR1NAMPTSOS1CDK7CDK13
SCHEMBL26312619 0.79 NAMPT (0.52) CNR1NAMPTSOS1CDK7CDK13

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023239645-A1 SMARCA DEGRADERS AND USES THEREOF KYMERA THERAPEUTICS, INC. (US) 2023-12-14 — — WO disclosed
WO-2023278402-A1 SMARCA DEGRADERS AND USES THEREOF KYMERA THERAPEUTICS, INC. (US) 2023-01-05 — — WO disclosed
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