SCHEMBL23032772

SCHEMBL23032772

C#C/C=c1/sc2ccccc2/c1=C/C

nearest known ligand 0.38

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ GPR3 P46089 1/20 0.38
▸ KDM4E B2RXH2 1/20 0.32
▸ LMNA P02545 1/20 0.32
▸ CASP1 P29466 1/20 0.32
▸ ALDH1A1 P00352 1/20 0.32
▸ MAPT P10636 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
SCHEMBL19658375 0.82 GPR3 (0.46) GPR3KDM4ELMNACASP1ALDH1A1
SCHEMBL25886243 0.76 — —
SCHEMBL26028887 0.76 GPR3 (0.38) GPR3KDM4ELMNAALDH1A1MAPT
SCHEMBL18560415 0.76 GPR3 (0.40) GPR3KDM4ELMNACASP1ALDH1A1
SCHEMBL24609172 0.75 GPR3 (0.39) GPR3KDM4ELMNACASP1ALDH1A1
SCHEMBL23544032 0.72 GPR3 (0.36) GPR3KDM4ELMNACASP1ALDH1A1
SCHEMBL25634912 0.72 GPR3 (0.36) GPR3KDM4ELMNACASP1ALDH1A1
SCHEMBL17950785 0.71 GPR3 (0.39) GPR3KDM4ELMNACASP1ALDH1A1
SCHEMBL20663041 0.71 GPR3 (0.35) GPR3KDM4ELMNACASP1ALDH1A1
SCHEMBL25521647 0.70 GPR3 (0.34) GPR3KDM4EALDH1A1MAPT

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-2021033730-A1 COMPOUND, MATERIAL FOR ORGANIC ELECTROLUMINESCENT ELEMENTS, ORGANIC ELECTROLUMINESCENT ELEMENT, AND ELECTRONIC DEVICE 出光興産株式会社 2021-02-25 — — WO disclosed
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