SCHEMBL27458407

SCHEMBL27458407

CN1CCC(c2ccnc(N3[C@@H]4CC[C@H]3CN(c3cc(-c5cc(F)ccc5O)nnc3N)C4)n2)CC1

nearest known ligand 0.49

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ SMARCA2 P51531 13/20 0.49
▸ SMARCA4 P51532 13/20 0.49
▸ PBRM1 Q86U86 14/20 0.39
▸ NR1I2 O75469 6/20 0.37
▸ BRD4 O60885 1/20 0.36
▸ NR1H2 P55055 2/20 0.35
▸ NR1H3 Q13133 2/20 0.35
▸ CDK1 P06493 1/20 0.35
▸ CDK2 P24941 1/20 0.35
▸ MAPK14 Q16539 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
SCHEMBL30796060 0.89 SMARCA2 (0.47) SMARCA2SMARCA4PBRM1NR1I2BRD4
SCHEMBL27458402 0.89 SMARCA2 (0.47) SMARCA2SMARCA4PBRM1NR1I2BRD4
SCHEMBL30796207 0.87 SMARCA2 (0.51) SMARCA2SMARCA4PBRM1
SCHEMBL27458085 0.83 SMARCA2 (0.48) SMARCA2SMARCA4PBRM1NR1I2BRD4
SCHEMBL27261742 0.80 SMARCA2 (0.50) SMARCA2SMARCA4PBRM1NR1I2BRD4
SCHEMBL30796712 0.79 SMARCA2 (0.59) SMARCA2SMARCA4PBRM1NR1I2BRD4
SCHEMBL27458272 0.79 SMARCA2 (0.59) SMARCA2SMARCA4PBRM1NR1I2BRD4
SCHEMBL31536353 0.79 SMARCA2 (0.59) SMARCA2SMARCA4PBRM1NR1I2BRD4
SCHEMBL30796686 0.79 SMARCA2 (0.59) SMARCA2SMARCA4PBRM1NR1I2BRD4
SCHEMBL27458561 0.79 SMARCA2 (0.59) SMARCA2SMARCA4PBRM1NR1I2BRD4

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-2023244764-A1 COMPOUNDS FOR THE TARGETED DEGRADATION OF SMARCA2 C4 THERAPEUTICS, INC. (US) 2023-12-21 — — WO disclosed
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