SCHEMBL30182783

SCHEMBL30182783

Nc1cccc2cc(O)ccc12

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 5/20 0.54
▸ CYP3A4 P08684 3/20 0.54
▸ HPGD P15428 3/20 0.54
▸ TSHR P16473 2/20 0.54
▸ HSD17B10 Q99714 2/20 0.54
▸ KEAP1 Q14145 1/20 0.54
▸ PLAU P00749 2/20 0.48
▸ CYP1A2 P05177 2/20 0.48
▸ ESR1 P03372 5/20 0.46
▸ ESR2 Q92731 5/20 0.46
▸ HSD17B1 P14061 1/20 0.46
▸ HSD17B2 P37059 1/20 0.46
▸ TLR8 Q9NR97 1/20 0.45
▸ F2 P00734 1/20 0.44
▸ PLG P00747 1/20 0.44
▸ PLAT P00750 1/20 0.44
▸ KLK1 P06870 1/20 0.44
▸ PRSS1 P07477 1/20 0.44
▸ TDP1 Q9NUW8 3/20 0.44
▸ LMNA P02545 2/20 0.44

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
SCHEMBL8006496 1.00 ALDH1A1 (0.54) ALDH1A1CYP3A4HPGDTSHRHSD17B10
SCHEMBL117031 1.00 ALDH1A1 (0.54) ALDH1A1CYP3A4HPGDTSHRHSD17B10
3-Aminophenol SCHEMBL8000117 0.91 ALDH1A1 (0.61) ALDH1A1CYP3A4HPGDTSHRHSD17B10
Betanaphthol SCHEMBL10712099 0.84 ALDH1A1 (0.63) ALDH1A1CYP3A4HPGDTSHRHSD17B10
Tyramine SCHEMBL8006483 0.83 TAAR1 (0.55) ALDH1A1CYP3A4HPGDTSHRHSD17B10
SCHEMBL208278 0.83 F2 (0.58) ALDH1A1CYP3A4HPGDTSHRHSD17B10
SCHEMBL8001257 0.83 F2 (0.58) ALDH1A1CYP3A4HPGDTSHRHSD17B10
SCHEMBL29792935 0.83 F2 (0.58) ALDH1A1CYP3A4HPGDTSHRHSD17B10
Hydroquinone SCHEMBL9776726 0.81 F2 (0.56) ALDH1A1CYP3A4HPGDTSHRHSD17B10
SCHEMBL29394466 0.81 F2 (0.56) ALDH1A1CYP3A4HPGDTSHRHSD17B10

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-2023017839-A1 POLYESTER FILM AND METAL-CLAD LAMINATED BOARD ENEOS株式会社 2023-02-16 — — WO disclosed
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