SCHEMBL22706259

SCHEMBL22706259

c1ccc(-c2c3cccc(-c4ccc(-c5cccc6oc7ccccc7c56)cc4)c3cc3c(-c4ccc(-c5cccc6oc7ccccc7c56)cc4)cccc23)cc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALOX5 P09917 1/20 0.41
▸ CA1 P00915 2/20 0.39
▸ CA2 P00918 2/20 0.39
▸ PLA2G2A P14555 5/20 0.37
▸ PLA2G4A P47712 5/20 0.37
▸ CYP3A4 P08684 2/20 0.37
▸ HPGD P15428 2/20 0.37
▸ SMN1; SMN2 Q16637 2/20 0.37
▸ RAB9A P51151 2/20 0.37
▸ GABRP O00591 1/20 0.37
▸ GABRD O14764 1/20 0.37
▸ NPC1 O15118 1/20 0.37
▸ CA12 O43570 1/20 0.37
▸ TNKS O95271 1/20 0.37
▸ TP53 P04637 1/20 0.37
▸ ABCB1 P08183 1/20 0.37
▸ PARP1 P09874 1/20 0.37
▸ ADORA3 P0DMS8 1/20 0.37
▸ AR P10275 1/20 0.37
▸ CYP19A1 P11511 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
SCHEMBL22707402 0.94 ALOX5 (0.41) ALOX5CA1CA2PLA2G2APLA2G4A
SCHEMBL17917504 0.94 CA1 (0.42) ALOX5CA1CA2PLA2G2APLA2G4A
SCHEMBL22062616 0.92 CA1 (0.41) ALOX5CA1CA2PLA2G2APLA2G4A
SCHEMBL22706421 0.91 ALOX5 (0.41) ALOX5CA1CA2PLA2G2APLA2G4A
SCHEMBL22063324 0.91 CDC14B (0.39) ALOX5CA1CA2PLA2G2APLA2G4A
SCHEMBL22707748 0.91 CA1 (0.41) ALOX5CA1CA2PLA2G2APLA2G4A
SCHEMBL22062618 0.90 PLA2G2A (0.44) ALOX5CA1CA2PLA2G2APLA2G4A
SCHEMBL22063086 0.89 CA1 (0.40) ALOX5CA1CA2PLA2G2APLA2G4A
SCHEMBL22705939 0.89 CA1 (0.40) ALOX5CA1CA2PLA2G2APLA2G4A
SCHEMBL22707094 0.89 CA1 (0.40) ALOX5CA1CA2PLA2G2APLA2G4A

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
US-20200373496-A1 ORGANIC LIGHT EMITTING ELEMENT LG CHEM, LTD. (KR) 2020-11-26 — — US disclosed
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