SCHEMBL29072082

SCHEMBL29072082

O=C(O)N1Cc2[nH]c3nnc(-c4ccccc4O)cc3c2C1

nearest known ligand 0.39

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ SMARCA2 P51531 9/20 0.39
▸ SMARCA4 P51532 9/20 0.39
▸ PBRM1 Q86U86 8/20 0.39
▸ NR1I2 O75469 3/20 0.39
▸ BRD4 O60885 2/20 0.39
▸ CDK4 P11802 6/20 0.36
▸ CCND1 P24385 6/20 0.36
▸ TRPV1 Q8NER1 3/20 0.33

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
SCHEMBL27040297 0.85 PARP1 (0.44) —
SCHEMBL30552545 0.85 PARP1 (0.44) —
SCHEMBL30552396 0.82 BAZ2B (0.41) SMARCA2SMARCA4PBRM1NR1I2
SCHEMBL24461314 0.82 BAZ2B (0.55) SMARCA2SMARCA4PBRM1BRD4
SCHEMBL23580634 0.81 MTHFD2 (0.39) SMARCA2SMARCA4PBRM1NR1I2BRD4
SCHEMBL23607097 0.78 PBRM1 (0.40) SMARCA2SMARCA4PBRM1NR1I2BRD4
SCHEMBL23607105 0.78 PBRM1 (0.40) SMARCA2SMARCA4PBRM1NR1I2BRD4
SCHEMBL27064491 0.78 SMARCA2 (0.38) SMARCA2SMARCA4PBRM1NR1I2BRD4
SCHEMBL24461467 0.78 PBRM1 (0.42) SMARCA2SMARCA4PBRM1NR1I2BRD4
SCHEMBL30552623 0.78 PBRM1 (0.42) 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
CN-116744929-A Compounds and uses thereof 福霍恩治疗公司 2023-09-12 — — CN disclosed
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