SCHEMBL27401702

SCHEMBL27401702

C=C(C)N1CCN(C(=O)c2cc(-c3cn(C/C=C/C)c(=O)c4[nH]ccc34)c3ncn(C)c3c2)CC1

nearest known ligand 0.69

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
BRD9 Q9H8M2 15/20 0.69
TAF1 P21675 7/20 0.69
CECR2 Q9BXF3 7/20 0.69
BRD4 O60885 5/20 0.69
TAF1L Q8IZX4 2/20 0.69
TAF11 Q15544 1/20 0.69
BRD7 Q9NPI1 2/20 0.53
TRIM24 O15164 1/20 0.53
BRD2 P25440 1/20 0.53
SMARCA4 P51532 1/20 0.53
BRD3 Q15059 1/20 0.53
BRDT Q58F21 1/20 0.53
PBRM1 Q86U86 1/20 0.53
BRWD1 Q9NSI6 1/20 0.53

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
SCHEMBL27401699 0.85 CECR2 (0.86) BRD9TAF1CECR2BRD4TAF1L
SCHEMBL17749835 0.82 CECR2 (1.00) BRD9TAF1CECR2BRD4TAF1L
SCHEMBL29666958 0.82 CECR2 (1.00) BRD9TAF1CECR2BRD4TAF1L
SCHEMBL19640307 0.77 CECR2 (0.76) BRD9TAF1CECR2BRD4TAF1L
SCHEMBL19657354 0.74 BRD9 (0.87) BRD9TAF1CECR2BRD4BRD7
SCHEMBL17749880 0.73 TAF1 (1.00) BRD9TAF1CECR2BRD4TAF1L
SCHEMBL19640301 0.73 TAF1 (1.00) BRD9TAF1CECR2BRD4TAF1L
SCHEMBL30073232 0.72 BRD9 (1.00) BRD9TAF1CECR2BRD4BRD7
SCHEMBL29482225 0.72 CECR2 (1.00) BRD9TAF1CECR2BRD4BRD7
SCHEMBL17749790 0.72 BRD9 (1.00) BRD9TAF1CECR2BRD4BRD7

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-2024086304-A1 METHODS AND COMPOSITIONS FOR TREATMENT OF OPHTHALMIC DISEASE Design Therapeutics, Inc. (US) 2024-04-25 WO disclosed