SCHEMBL30836614

SCHEMBL30836614

COC(OC)c1ccc(C(=O)Nc2cccc(B3OC(C)(C)C(C)(C)O3)c2C)nc1

nearest known ligand 0.50

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ LIPE Q05469 8/20 0.50
▸ PDCD1 Q15116 9/20 0.39
▸ CD274 Q9NZQ7 9/20 0.39
▸ MEN1 O00255 1/20 0.37
▸ AHR P35869 1/20 0.37
▸ KMT2A Q03164 1/20 0.37
▸ NPC1 O15118 1/20 0.37
▸ RAB9A P51151 1/20 0.37

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
SCHEMBL20293697 1.00 LIPE (0.50) LIPEPDCD1CD274MEN1AHR
SCHEMBL30836715 0.90 LIPE (0.50) LIPEPDCD1CD274MEN1AHR
SCHEMBL20293126 0.90 LIPE (0.50) LIPEPDCD1CD274MEN1AHR
SCHEMBL20293076 0.89 LIPE (0.52) LIPEMEN1AHRKMT2ANPC1
SCHEMBL31108221 0.85 LIPE (0.41) LIPEPDCD1CD274
SCHEMBL31108271 0.84 LIPE (0.52) LIPEPDCD1CD274MEN1AHR
SCHEMBL31108218 0.81 PDCD1 (0.50) LIPEPDCD1CD274
SCHEMBL30836769 0.81 LIPE (0.50) LIPEPDCD1CD274NPC1RAB9A
SCHEMBL30836800 0.79 MEN1 (0.43) PDCD1CD274MEN1AHRKMT2A
SCHEMBL21622909 0.78 PDCD1 (0.49) LIPEPDCD1CD274

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4694981-A1 HETEROCYCLIC COMPOUNDS AS DUAL INHIBITORS OF PD-L1 AND ADENOSINE RECEPTORS Aurigene Oncology Limited (IN) 2026-02-18 — — EP disclosed
WO-2024214088-A1 HETEROCYCLIC COMPOUNDS AS DUAL INHIBITORS OF PD-L1 AND ADENOSINE RECEPTORS AURIGENE ONCOLOGY LIMITED (IN) 2024-10-17 — — WO disclosed
WO-2024069448-A1 SUBSTITUTED 1-ARYLAMINOCARBONYL-1'-HETEROARYL COMPOUNDS, SUBSTITUTED 1-HETEROARYLAMINOCARBONYL-1'-HETEROARYL COMPOUNDS AND METHODS USING SAME ARBUTUS BIOPHARMA CORPORATION (CA) 2024-04-04 — — WO disclosed
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