SCHEMBL27461434

SCHEMBL27461434

CC(C)(C)OC(=O)N1CCC(c2ccnc(-c3cc(-c4ccccc4O)nnc3N)c2)CC1

nearest known ligand 0.62

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ SMARCA2 P51531 10/20 0.62
▸ SMARCA4 P51532 10/20 0.62
▸ PBRM1 Q86U86 8/20 0.62
▸ GPR119 Q8TDV5 4/20 0.43
▸ NAMPT P43490 1/20 0.42
▸ JAK2 O60674 1/20 0.41
▸ JAK3 P52333 1/20 0.41
▸ PTK2 Q05397 1/20 0.41
▸ NR1I2 O75469 4/20 0.41
▸ NR1H2 P55055 1/20 0.41
▸ HTT P42858 1/20 0.41
▸ MEN1 O00255 1/20 0.40
▸ KMT2A Q03164 1/20 0.40
▸ USP30 Q70CQ3 1/20 0.40
▸ NR1H3 Q13133 1/20 0.40

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
SCHEMBL30797067 1.00 SMARCA2 (0.62) SMARCA2SMARCA4PBRM1GPR119NAMPT
SCHEMBL31548738 0.86 SMARCA2 (0.65) SMARCA2SMARCA4PBRM1NAMPTJAK2
SCHEMBL30796907 0.85 SMARCA2 (0.61) SMARCA2SMARCA4PBRM1GPR119NAMPT
SCHEMBL27461726 0.85 SMARCA2 (0.61) SMARCA2SMARCA4PBRM1GPR119NAMPT
SCHEMBL20009090 0.85 SMARCA2 (0.71) SMARCA2SMARCA4PBRM1GPR119NR1I2
SCHEMBL30606905 0.85 SMARCA2 (0.71) SMARCA2SMARCA4PBRM1GPR119NR1I2
SCHEMBL27461170 0.84 SMARCA2 (0.72) SMARCA2SMARCA4PBRM1GPR119NR1I2
SCHEMBL30796629 0.84 SMARCA2 (0.72) SMARCA2SMARCA4PBRM1GPR119NR1I2
SCHEMBL24514506 0.82 PBRM1 (0.75) SMARCA2SMARCA4PBRM1GPR119NR1I2
SCHEMBL30606896 0.81 PBRM1 (0.66) SMARCA2SMARCA4PBRM1NR1I2NR1H2

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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