SCHEMBL30255236

SCHEMBL30255236

Cc1ncc(Br)c(N2CCC(NC(=O)O)CC2)c1C=O

nearest known ligand 0.35

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ CKS1B P61024 3/20 0.35
▸ SKP1 P63208 3/20 0.35
▸ SKP2 Q13309 3/20 0.35
▸ OPRK1 P41145 6/20 0.34
▸ FFAR4 Q5NUL3 1/20 0.33
▸ PIK3CA P42336 1/20 0.33
▸ MTOR P42345 1/20 0.33
▸ GRIN2B Q13224 2/20 0.33
▸ SMPD3 Q9NY59 1/20 0.33
▸ PAK1 Q13153 1/20 0.32

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
SCHEMBL30255015 0.87 KDM4E (0.37) CKS1BSKP1SKP2OPRK1PIK3CA
SCHEMBL30254917 0.86 OPRK1 (0.36) CKS1BSKP1SKP2OPRK1
SCHEMBL20500351 0.86 CKS1B (0.47) CKS1BSKP1SKP2OPRK1
SCHEMBL20500375 0.74 CKS1B (0.46) CKS1BSKP1SKP2OPRK1
SCHEMBL21810299 0.74 CKS1B (0.46) CKS1BSKP1SKP2OPRK1
SCHEMBL16694846 0.74 CYP3A4 (0.39) CKS1BSKP1SKP2OPRK1PIK3CA
SCHEMBL23658236 0.73 CKS1B (0.46) CKS1BSKP1SKP2OPRK1
SCHEMBL20500497 0.73 CKS1B (0.45) CKS1BSKP1SKP2OPRK1
SCHEMBL21810232 0.73 CKS1B (0.45) CKS1BSKP1SKP2OPRK1
SCHEMBL21248811 0.71 SMPD3 (0.35) OPRK1FFAR4SMPD3

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-110650951-B Somatostatin modulators and uses thereof 克林提克斯医药股份有限公司 2023-02-24 — — CN disclosed
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