SCHEMBL29549838

SCHEMBL29549838

O=C1c2ccccc2Cc2cccc(O)c21

nearest known ligand 0.75

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 5/20 0.75
▸ ALDH1A1 P00352 4/20 0.75
▸ KMT2A Q03164 4/20 0.75
▸ MEN1 O00255 3/20 0.75
▸ TDP1 Q9NUW8 3/20 0.75
▸ ALOX15 P16050 2/20 0.75
▸ TSHR P16473 2/20 0.75
▸ HSD17B10 Q99714 2/20 0.75
▸ USP2 O75604 2/20 0.75
▸ HPN P05981 1/20 0.75
▸ CYP3A4 P08684 1/20 0.75
▸ ALOX5 P09917 1/20 0.75
▸ THRB P10828 1/20 0.75
▸ PTGS1 P23219 1/20 0.75
▸ PDE4A P27815 1/20 0.75
▸ KDR P35968 1/20 0.75
▸ SIRT5 Q9NXA8 1/20 0.75
▸ L3MBTL1 Q9Y468 1/20 0.75
▸ HRH3 Q9Y5N1 1/20 0.75
▸ MAOA P21397 4/20 0.61

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
SCHEMBL1204733 1.00 MAPT (0.75) MAPTALDH1A1KMT2AMEN1TDP1
Anthralin SCHEMBL29439039 0.86 MAPT (1.00) MAPTALDH1A1KMT2AMEN1TDP1
Anthralin SCHEMBL3197 0.86 MAPT (1.00) MAPTALDH1A1KMT2AMEN1TDP1
Anthralin SCHEMBL30013383 0.86 MAPT (1.00) MAPTALDH1A1KMT2AMEN1TDP1
Anthralin SCHEMBL7555831 0.84 MAPT (0.96) MAPTALDH1A1KMT2AMEN1TDP1
SCHEMBL1626149 0.84 MAPT (0.61) MAPTALDH1A1KMT2AMEN1TDP1
SCHEMBL30844848 0.84 MAPT (0.61) MAPTALDH1A1KMT2AMEN1TDP1
SCHEMBL769934 0.84 MAOA (0.71) MAPTALDH1A1KMT2AMEN1TDP1
SCHEMBL8205266 0.84 ALDH1A1 (0.53) MAPTALDH1A1KMT2AMEN1TDP1
SCHEMBL8756171 0.84 MAPT (0.67) MAPTALDH1A1KMT2AMEN1TDP1

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109890793-B Novel anthelmintic quinoline-3-carboxamide derivatives 拜耳动物保健有限责任公司 2022-11-18 — — CN disclosed
CN-114591232-A Long-acting control agent for ectoparasites of animals 三井化学AGRO株式会社 2022-06-07 — — CN disclosed
CN-111132549-B Long-acting control agent for ectoparasites of animals 三井化学AGRO株式会社 2022-04-12 — — CN disclosed
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