SCHEMBL26200649

SCHEMBL26200649

C/C=C\c1c(C)c2ccccc2n1-c1cccc2c1c1ccccc1n2C

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ GPR3 P46089 1/20 0.39
▸ MAPT P10636 3/20 0.37
▸ KDM4E B2RXH2 2/20 0.37
▸ HTT P42858 2/20 0.37
▸ TOP2A P11388 2/20 0.36
▸ BCHE P06276 4/20 0.35
▸ ACHE P22303 4/20 0.35
▸ NQO2 P16083 1/20 0.35
▸ ALKBH5 Q6P6C2 1/20 0.35
▸ FTO Q9C0B1 1/20 0.35
▸ CYP11B2 P19099 1/20 0.35
▸ GABRP O00591 1/20 0.33
▸ GABRD O14764 1/20 0.33
▸ GABRA1 P14867 1/20 0.33
▸ GABRB1 P18505 1/20 0.33
▸ GABRG2 P18507 1/20 0.33
▸ GABRB3 P28472 1/20 0.33
▸ GABRA5 P31644 1/20 0.33
▸ GABRA3 P34903 1/20 0.33
▸ GABRA2 P47869 1/20 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
SCHEMBL19849118 0.84 GPR3 (0.36) GPR3MAPTKDM4EHTTTOP2A
SCHEMBL19789714 0.80 — —
SCHEMBL15275556 0.78 GPR3 (0.59) GPR3MAPTKDM4EHTTBCHE
SCHEMBL18626391 0.78 GPR3 (0.48) GPR3MAPTKDM4EHTTTOP2A
SCHEMBL24972987 0.78 ALDH1A1 (0.36) GPR3MAPTKDM4EHTTALDH1A1
SCHEMBL22906561 0.77 GPR3 (0.57) GPR3MAPTKDM4EHTTBCHE
SCHEMBL20692453 0.74 KDM4E (0.50) MAPTKDM4EHTTTSHRALDH1A1
SCHEMBL23373471 0.73 GPR3 (0.52) GPR3MAPTKDM4EHTTBCHE
SCHEMBL19789897 0.73 GPR3 (0.34) GPR3MAPTHTTBCHEACHE
SCHEMBL19849213 0.72 GPR3 (0.34) GPR3MAPTKDM4EHTTTOP2A

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-2023162701-A1 MATERIAL FOR ORGANIC ELECTROLUMINESCENT ELEMENT, AND ORGANIC ELECTROLUMINESCENT ELEMENT 日鉄ケミカル&マテリアル株式会社 2023-08-31 — — WO disclosed
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