SCHEMBL26145174

SCHEMBL26145174

C/C=C/c1cccc(-c2cccc(-c3ccc4[nH]c5ccccc5c4c3)c2)c1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KIF11 P52732 5/20 0.45
▸ AHR P35869 1/20 0.43
▸ KDM4E B2RXH2 3/20 0.42
▸ ALDH1A1 P00352 2/20 0.42
▸ HSD17B10 Q99714 2/20 0.42
▸ KMT2A Q03164 2/20 0.42
▸ MAPT P10636 2/20 0.42
▸ MEN1 O00255 1/20 0.42
▸ HPGD P15428 1/20 0.42
▸ GPR3 P46089 1/20 0.40
▸ GABRA1 P14867 4/20 0.38
▸ GABRG2 P18507 4/20 0.38
▸ GABRB3 P28472 4/20 0.38
▸ GABRA5 P31644 4/20 0.38
▸ GABRA3 P34903 4/20 0.38
▸ GABRA2 P47869 4/20 0.38
▸ GABRA6 Q16445 4/20 0.38
▸ GABRP O00591 3/20 0.38
▸ GABRD O14764 3/20 0.38
▸ GABRB1 P18505 3/20 0.38

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
SCHEMBL8124645 0.83 KIF11 (0.64) KIF11AHRKDM4EALDH1A1HSD17B10
SCHEMBL19500811 0.83 AHR (0.61) KIF11AHRKDM4EALDH1A1HSD17B10
SCHEMBL18595766 0.80 AHR (0.57) KIF11AHRKDM4EALDH1A1HSD17B10
SCHEMBL21096036 0.80 AHR (0.57) KIF11AHRKDM4EALDH1A1HSD17B10
SCHEMBL17166808 0.80 AHR (0.57) KIF11AHRKDM4EALDH1A1HSD17B10
SCHEMBL18931247 0.78 AHR (0.55) KIF11AHRKDM4EALDH1A1HSD17B10
SCHEMBL18931273 0.78 AHR (0.55) KIF11AHRKDM4EALDH1A1HSD17B10
SCHEMBL17835052 0.78 AHR (0.55) KIF11AHRKDM4EALDH1A1HSD17B10
SCHEMBL31405535 0.78 AHR (0.64) KIF11AHRKDM4EALDH1A1HSD17B10
SCHEMBL16127349 0.78 AHR (0.70) KIF11AHRKDM4EALDH1A1HSD17B10

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-2023085171-A1 COMPOSITION, ORGANIC ELECTROLUMINESCENT ELEMENT AND METHOD FOR PRODUCING SAME, DISPLAY DEVICE, AND LIGHTING DEVICE 三菱ケミカル株式会社 2023-05-19 — — WO disclosed
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