SCHEMBL27007443

SCHEMBL27007443

COCC(C)(C)n1cc2cc(B3OC(C)(C)C(C)(C)O3)ccc2n1

nearest known ligand 0.37

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ SNCA P37840 1/20 0.37
▸ DGAT1 O75907 1/20 0.37
▸ FFAR1 O14842 1/20 0.36
▸ LPL P06858 8/20 0.33
▸ LIPG Q9Y5X9 8/20 0.33
▸ IDO1 P14902 1/20 0.33
▸ TDO2 P48775 1/20 0.33
▸ IRAK4 Q9NWZ3 1/20 0.33
▸ PRMT5 O14744 1/20 0.32
▸ WDR77 Q9BQA1 1/20 0.32
▸ AAK1 Q2M2I8 1/20 0.32
▸ HIF1A Q16665 1/20 0.31
▸ ROCK1 Q13464 1/20 0.31

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
SCHEMBL27007442 0.81 DGAT1 (0.46) SNCADGAT1FFAR1IDO1TDO2
SCHEMBL28877892 0.78 F11 (0.41) SNCADGAT1FFAR1LPLLIPG
SCHEMBL23529729 0.76 SNCA (0.38) SNCADGAT1FFAR1LPLLIPG
SCHEMBL907049 0.74 KDM4E (0.40) SNCALPLLIPGIDO1TDO2
SCHEMBL17437290 0.74 FFAR1 (0.57) SNCADGAT1FFAR1LPLLIPG
SCHEMBL17113584 0.74 LPL (0.41) SNCAFFAR1LPLLIPGIDO1
SCHEMBL30124853 0.74 FFAR1 (0.53) DGAT1FFAR1LPLLIPGIRAK4
SCHEMBL23546525 0.73 SNCA (0.36) SNCAFFAR1LPLLIPGIDO1
SCHEMBL30928610 0.73 IDO1 (0.39) SNCAFFAR1LPLLIPGIDO1
SCHEMBL23533548 0.72 FFAR1 (0.36) SNCADGAT1FFAR1LPLLIPG

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
EP-4306520-A1 THIOPHENE COMPOUND AND APPLICATION THEREOF Medshine Discovery Inc. (CN) 2024-01-17 — — EP disclosed
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