SCHEMBL29471235

SCHEMBL29471235

COc1cc(N2CCN(C(C)=O)c3cc(-c4cnn(C)c4)c(C#N)cc32)c2cc(C)c(=O)n(C)c2c1

nearest known ligand 0.39

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ USP30 Q70CQ3 1/20 0.39
▸ CREBBP Q92793 6/20 0.35
▸ PIK3CD O00329 2/20 0.35
▸ ATM Q13315 1/20 0.35
▸ FGFR3 P22607 7/20 0.34
▸ FGFR2 P21802 6/20 0.34
▸ FGFR1 P11362 6/20 0.34
▸ CSF1R P07333 1/20 0.33
▸ BRD4 O60885 1/20 0.33
▸ MAP4K1 Q92918 1/20 0.33
▸ EP300 Q09472 1/20 0.32
▸ RET P07949 1/20 0.32
▸ FGFR4 P22455 2/20 0.32
▸ KDR P35968 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
SCHEMBL24316691 1.00 USP30 (0.39) USP30CREBBPPIK3CDATMFGFR3
SCHEMBL24316889 0.92 USP30 (0.38) USP30CREBBPATMFGFR3FGFR2
SCHEMBL29471215 0.90 CREBBP (0.40) USP30CREBBPPIK3CDATMFGFR3
SCHEMBL24316602 0.90 CREBBP (0.40) USP30CREBBPPIK3CDATMFGFR3
SCHEMBL24316769 0.86 FGFR1 (0.38) USP30CREBBPPIK3CDATMFGFR3
SCHEMBL26548319 0.86 ATM (0.36) USP30CREBBPPIK3CDATMFGFR3
SCHEMBL30480852 0.85 FGFR2 (0.36) USP30CREBBPATMFGFR3FGFR2
SCHEMBL24316892 0.85 FGFR2 (0.36) USP30CREBBPATMFGFR3FGFR2
SCHEMBL24317125 0.84 USP30 (0.38) USP30CREBBPPIK3CDATMFGFR3
SCHEMBL24316782 0.84 RET (0.39) USP30ATMFGFR3FGFR2FGFR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4210683-A1 HETEROCYCLIC COMPOUNDS AS CBP/EP300 BROMODOMAIN INHIBITORS Aurigene Oncology Limited (IN) 2023-07-19 — — EP disclosed
CN-116368128-A Heterocyclic compounds as CBP/EP300 bromodomain inhibitors 奥瑞基尼肿瘤有限公司 2023-06-30 — — CN disclosed
WO-2022053967-A1 HETEROCYCLIC COMPOUNDS AS CBP/EP300 BROMODOMAIN INHIBITORS AURIGENE DISCOVERY TECHNOLOGIES LIMITED (IN) 2022-03-17 — — WO disclosed
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