SCHEMBL31414645

SCHEMBL31414645

OCCN(CCO)CC(O)COc1ccccc1

nearest known ligand 0.67

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 4/20 0.67
▸ GAA P10253 3/20 0.67
▸ MAPK1 P28482 2/20 0.67
▸ MAPT P10636 1/20 0.67
▸ LMNA P02545 2/20 0.62
▸ TSHR P16473 1/20 0.61
▸ POLB P06746 1/20 0.58
▸ NCOA3 Q9Y6Q9 1/20 0.56
▸ KDM4E B2RXH2 2/20 0.55
▸ TDP1 Q9NUW8 1/20 0.52
▸ NPSR1 Q6W5P4 1/20 0.51
▸ L3MBTL1 Q9Y468 1/20 0.47
▸ ADRB2 P07550 1/20 0.47
▸ ADRB1 P08588 1/20 0.47
▸ CYP2D6 P10635 1/20 0.47
▸ ADRB3 P13945 1/20 0.47
▸ HIF1A Q16665 1/20 0.47

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
SCHEMBL31414644 1.00 ALDH1A1 (0.67) ALDH1A1GAAMAPK1MAPTLMNA
SCHEMBL759782 0.97 ALDH1A1 (0.67) ALDH1A1GAAMAPK1MAPTLMNA
SCHEMBL11449950 0.85 ALDH1A1 (0.54) ALDH1A1GAAMAPK1MAPTLMNA
SCHEMBL12212607 0.84 KDM4E (0.59) ALDH1A1GAAMAPK1MAPTLMNA
SCHEMBL12403146 0.84 GAA (0.64) ALDH1A1GAAMAPK1MAPTLMNA
SCHEMBL10760842 0.81 POLB (0.78) ALDH1A1MAPK1MAPTLMNATSHR
SCHEMBL13952042 0.81 POLB (0.78) ALDH1A1GAAMAPK1MAPTLMNA
SCHEMBL11672344 0.81 MAPK1 (0.69) ALDH1A1GAAMAPK1MAPTLMNA
SCHEMBL6931910 0.81 MAPK1 (0.69) ALDH1A1GAAMAPK1MAPTLMNA
SCHEMBL9636165 0.80 ALDH1A1 (0.62) ALDH1A1GAAMAPK1MAPTLMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119409959-B Outdoor hydrolysis-resistant polyester resin and preparation method and application thereof 安徽永昌新材料科技股份有限公司 2025-04-25 — — CN claimed
CN-119409959-A Outdoor hydrolysis-resistant polyester resin and preparation method and application thereof 安徽永昌新材料科技股份有限公司 2025-02-11 — — CN claimed
CN-119409959-B Outdoor hydrolysis-resistant polyester resin and preparation method and application thereof 安徽永昌新材料科技股份有限公司 2025-04-25 — — CN disclosed
CN-119409959-A Outdoor hydrolysis-resistant polyester resin and preparation method and application thereof 安徽永昌新材料科技股份有限公司 2025-02-11 — — CN disclosed
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