SCHEMBL25679974

SCHEMBL25679974

c1ccc(-c2nc(-c3ccc4cc(-c5ccc6oc7ccccc7c6c5)ccc4c3)nc(-c3c(-c4ccccc4)ccc4ccccc34)n2)cc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 7/20 0.40
▸ MAPT P10636 7/20 0.40
▸ ALDH1A1 P00352 6/20 0.40
▸ HPGD P15428 5/20 0.40
▸ HSD17B10 Q99714 4/20 0.40
▸ TSHR P16473 3/20 0.40
▸ ALOX15 P16050 1/20 0.40
▸ CASP1 P29466 1/20 0.40
▸ CASP7 P55210 1/20 0.40
▸ KMT2A Q03164 4/20 0.38
▸ MAPK1 P28482 2/20 0.38
▸ MEN1 O00255 3/20 0.37
▸ SMN1; SMN2 Q16637 3/20 0.37
▸ CYP1A2 P05177 2/20 0.37
▸ TP53 P04637 2/20 0.37
▸ PLA2G2A P14555 3/20 0.37
▸ PLA2G4A P47712 3/20 0.37
▸ GLA P06280 2/20 0.36
▸ TDP1 Q9NUW8 2/20 0.36
▸ L3MBTL1 Q9Y468 2/20 0.36

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
SCHEMBL22161472 0.92 KDM4E (0.40) KDM4EMAPTALDH1A1HPGDHSD17B10
SCHEMBL25679964 0.92 KDM4E (0.40) KDM4EMAPTALDH1A1HPGDHSD17B10
SCHEMBL23759320 0.91 KDM4E (0.41) KDM4EMAPTALDH1A1HPGDHSD17B10
SCHEMBL23759328 0.89 KDM4E (0.42) KDM4EMAPTALDH1A1HPGDHSD17B10
SCHEMBL18818766 0.89 KDM4E (0.41) KDM4EMAPTALDH1A1HPGDHSD17B10
SCHEMBL18821103 0.88 ABCG2 (0.40) KDM4EMAPTALDH1A1HPGDHSD17B10
SCHEMBL23822580 0.88 KDM4E (0.38) KDM4EMAPTALDH1A1HPGDHSD17B10
SCHEMBL23821282 0.87 KDM4E (0.39) KDM4EMAPTALDH1A1HPGDHSD17B10
SCHEMBL23821709 0.87 KDM4E (0.39) KDM4EMAPTALDH1A1HPGDHSD17B10
SCHEMBL18818764 0.87 GPR84 (0.36) KDM4EMAPTALDH1A1HPGDHSD17B10

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
WO-2023112915-A1 COMPOUND, ORGANIC ELECTROLUMINESCENT ELEMENT MATERIAL, ORGANIC ELECTROLUMINESCENT ELEMENT, AND ELECTRONIC DEVICE 出光興産株式会社 2023-06-22 — — WO disclosed
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