SCHEMBL30993339

SCHEMBL30993339

CNC(=O)c1c[nH]c2c(N3CCCC3=O)cc(Br)cc12

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 2/20 0.42
▸ KMT2A Q03164 2/20 0.42
▸ CREBBP Q92793 9/20 0.40
▸ BRD4 O60885 3/20 0.39
▸ EP300 Q09472 3/20 0.39
▸ TRIM24 O15164 1/20 0.39
▸ BRD3 Q15059 1/20 0.39
▸ BRD9 Q9H8M2 1/20 0.39
▸ BRD7 Q9NPI1 1/20 0.39
▸ HSD17B10 Q99714 1/20 0.37
▸ CYP3A4 P08684 1/20 0.35
▸ CYP2C9 P11712 1/20 0.35
▸ PRKAB2 O43741 1/20 0.35
▸ PRKAG1 P54619 1/20 0.35
▸ PRKAA2 P54646 1/20 0.35
▸ PRKAA1 Q13131 1/20 0.35
▸ PRKAG3 Q9UGI9 1/20 0.35
▸ PRKAG2 Q9UGJ0 1/20 0.35
▸ PRKAB1 Q9Y478 1/20 0.35
▸ NPC1 O15118 1/20 0.35

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
SCHEMBL30993004 0.70 CREBBP (0.45) KMT2ACREBBPBRD4EP300TRIM24
SCHEMBL30993555 0.70 CREBBP (0.42) MEN1KMT2ACREBBPBRD4
SCHEMBL17185312 0.69 APOBEC3A (0.61) MEN1KMT2ACYP3A4CYP2C9NPC1
SCHEMBL30993379 0.69 CREBBP (0.41) KMT2ACREBBPBRD4EP300TRIM24
SCHEMBL5219361 0.68 GAA (0.44) MEN1KMT2AHSD17B10CYP3A4CYP2C9
SCHEMBL31023088 0.67 HSD17B10 (0.41) MEN1KMT2AHSD17B10CYP3A4CYP2C9
SCHEMBL30993826 0.67 CREBBP (0.39) KMT2ACREBBPBRD4EP300BRD3
SCHEMBL5220565 0.67 CTSD (0.42) MEN1KMT2AHSD17B10CYP3A4CYP2C9
SCHEMBL5221504 0.67 CTSD (0.51) MEN1KMT2AHSD17B10CYP3A4CYP2C9
SCHEMBL5216170 0.66 HSD17B10 (0.41) MEN1KMT2AHSD17B10CYP3A4CYP2C9

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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