SCHEMBL24514385

SCHEMBL24514385

Nc1nnc(-c2ccccc2O)cc1N1CC2CC3C(C1)CC3(c1ncc(C3CCN([C@H]4CC5(C[C@H](C(=O)O)C5)C4)CC3)cn1)C2

nearest known ligand 0.42

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ PBRM1 Q86U86 18/20 0.42
▸ SMARCA2 P51531 16/20 0.40
▸ SMARCA4 P51532 16/20 0.40
▸ BRD4 O60885 1/20 0.39
▸ NR1I2 O75469 8/20 0.39
▸ NR1H2 P55055 4/20 0.37
▸ NR1H3 Q13133 3/20 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
SCHEMBL24514396 0.95 PBRM1 (0.43) PBRM1SMARCA2SMARCA4BRD4NR1I2
SCHEMBL24513970 0.95 PBRM1 (0.41) PBRM1SMARCA2SMARCA4BRD4NR1I2
SCHEMBL24514306 0.93 PBRM1 (0.43) PBRM1SMARCA2SMARCA4BRD4NR1I2
SCHEMBL24514491 0.87 PBRM1 (0.38) PBRM1SMARCA2SMARCA4BRD4NR1I2
SCHEMBL24514594 0.87 SMARCA2 (0.43) PBRM1SMARCA2SMARCA4BRD4NR1I2
SCHEMBL24513946 0.86 PBRM1 (0.43) PBRM1SMARCA2SMARCA4BRD4NR1I2
SCHEMBL24513968 0.86 PBRM1 (0.39) PBRM1SMARCA2SMARCA4BRD4NR1I2
SCHEMBL24513942 0.85 PBRM1 (0.42) PBRM1SMARCA2SMARCA4BRD4NR1I2
SCHEMBL24514278 0.85 PBRM1 (0.41) PBRM1SMARCA2SMARCA4BRD4NR1I2
SCHEMBL24514279 0.85 PBRM1 (0.41) PBRM1SMARCA2SMARCA4BRD4NR1I2

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-2022125804-A1 SMARCA DEGRADERS AND USES THEREOF KYMERA THERAPEUTICS, INC. (US) 2022-06-16 — — WO disclosed
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