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SCHEMBL22915501

SCHEMBL22915501

CCCCCCCCOC(=O)CCc1cc(-n2nc3ccc(CCCCCCCCOC(=O)CCc4cc(-n5nc6ccc(Cl)cc6n5)c(O)c(C(C)(C)C)c4)cc3n2)c(O)c(C(C)(C)C)c1

nearest known ligand 0.38

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ EPHX2 P34913 5/20 0.38
▸ CNR2 P34972 7/20 0.36
▸ CNR1 P21554 7/20 0.35
▸ P2RY10 O00398 2/20 0.33

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
SCHEMBL9229451 0.96 EPHX2 (0.41) EPHX2CNR2CNR1P2RY10
SCHEMBL13030430 0.96 EPHX2 (0.41) EPHX2CNR2CNR1P2RY10
SCHEMBL78014 0.96 EPHX2 (0.41) EPHX2CNR2CNR1P2RY10
SCHEMBL9870753 0.93 CNR1 (0.40) EPHX2CNR1
SCHEMBL1864712 0.89 EPHX2 (0.40) EPHX2CNR2CNR1P2RY10
SCHEMBL7525719 0.89 GAA (0.38) EPHX2CNR1
SCHEMBL6863921 0.88 EPHX2 (0.39) EPHX2CNR2CNR1P2RY10
SCHEMBL6460885 0.88 ALDH1A1 (0.40) EPHX2CNR2CNR1P2RY10
SCHEMBL9615371 0.88 GAA (0.34) EPHX2CNR1
SCHEMBL19216392 0.88 EPHX2 (0.38) EPHX2CNR1

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-3203271-B1 BLUE LIGHT CUTTING OPTICAL MATERIAL COMPRISING A BENZOTRIAZOLE UV ABSORBER ESSILOR INT (FR) 2021-01-27 — — EP disclosed