SCHEMBL31528024

SCHEMBL31528024

CCN1C(=O)Cc2c1ccc(C)c2-c1c(O)cc(CCC(C)C)cc1O

nearest known ligand 0.35

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
BRD4 O60885 1/20 0.35
ATAD2 Q6PL18 1/20 0.33
BMPR1B O00238 1/20 0.31
BMPR1A P36894 1/20 0.31
TGFBR1 P36897 1/20 0.31
ACVRL1 P37023 1/20 0.31
ACVR1 Q04771 1/20 0.31
XIAP P98170 1/20 0.31
ESR1 P03372 1/20 0.30
ESR2 Q92731 1/20 0.30
BACE1 P56817 1/20 0.30
GSK3B P49841 1/20 0.30

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
SCHEMBL31528183 0.89 BRD4 (0.37) BRD4ATAD2BMPR1BBMPR1ATGFBR1
SCHEMBL31527976 0.89 ALDH1A1 (0.36) BRD4ATAD2GSK3B
SCHEMBL31528026 0.87 HTT (0.40) BRD4ATAD2
SCHEMBL31528013 0.86 ATAD2 (0.36) BRD4ATAD2BMPR1BBMPR1ATGFBR1
SCHEMBL31528070 0.86 HTT (0.40)
SCHEMBL31528146 0.85 ALOX5 (0.34) BRD4ATAD2BMPR1BBMPR1ATGFBR1
SCHEMBL31528216 0.84 BRD4 (0.38) BRD4ATAD2BMPR1BBMPR1ATGFBR1
SCHEMBL31528029 0.84 RXRA (0.35) BRD4ATAD2
SCHEMBL31528206 0.84 GPR84 (0.34) BRD4ATAD2
SCHEMBL31528073 0.83 ATAD2 (0.37) BRD4ATAD2BMPR1BBMPR1ATGFBR1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2025078811-A1 CANNABINOID COMPOUNDS AND USES THEREOF JAZZ PHARMACEUTICALS RESEARCH UK LIMITED (GB) 2025-04-17 WO claimed
WO-2025078811-A1 CANNABINOID COMPOUNDS AND USES THEREOF JAZZ PHARMACEUTICALS RESEARCH UK LIMITED (GB) 2025-04-17 WO disclosed