SCHEMBL22800802

SCHEMBL22800802

COCCCNCCCCCCCCO

nearest known ligand 0.42

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 8/20 0.42
ALDH1A1 P00352 6/20 0.42
HSD17B10 Q99714 1/20 0.42
GAA P10253 3/20 0.42
TSHR P16473 1/20 0.41
TP53 P04637 2/20 0.41
ALOX15 P16050 1/20 0.41
MAPK1 P28482 2/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
CYP1A2 P05177 1/20 0.40
CYP2D6 P10635 1/20 0.40
CYP2C19 P33261 1/20 0.40
KMT2A Q03164 2/20 0.39
MEN1 O00255 1/20 0.39
NPC1 O15118 1/20 0.39
LMNA P02545 1/20 0.39
TDP1 Q9NUW8 1/20 0.37
POLB P06746 1/20 0.37

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
SCHEMBL26516395 1.00 KDM4E (0.42) KDM4EALDH1A1HSD17B10GAATSHR
SCHEMBL22800848 1.00 KDM4E (0.42) KDM4EALDH1A1HSD17B10GAATSHR
SCHEMBL21361425 0.91 ALDH1A1 (0.45) KDM4EALDH1A1HSD17B10GAATSHR
SCHEMBL20649049 0.88 KDM4E (0.43) KDM4EALDH1A1HSD17B10GAATSHR
SCHEMBL706586 0.86
SCHEMBL13050784 0.84 ALDH1A1 (0.41) KDM4EALDH1A1GAATSHRMAPK1
SCHEMBL7067353 0.83 KDM4E (0.44) KDM4EALDH1A1HSD17B10GAATSHR
SCHEMBL4159314 0.83 MAPK1 (0.48) KDM4EALDH1A1GAATSHRMAPK1
SCHEMBL2864906 0.81
SCHEMBL27410388 0.81 ALDH1A1 (0.36) KDM4EALDH1A1HSD17B10GAATSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3760657-B1 HYDROPHILIZING AGENT FOR PRODUCTION OF SELF-EMULSIFYING POLYISOCYANATE COMPOSITION, SELF-EMULSIFYING POLYISOCYANATE COMPOSITION, COATING MATERIAL COMPOSITION, AND COATING FILM TOSOH CORP (JP) 2025-04-02 EP disclosed
US-12134677-B2 Hydrophilizing agent for production of self-emulsifying polyisocyanate composition, self-emulsifying polyisocyanate composition, coating material composition, and coating film TOSOH CORPORATION (JP) 2024-11-05 US disclosed
CN-111819214-B Hydrophilizing agent for producing self-emulsifiable polyisocyanate composition, coating composition, and coating film 东曹株式会社 2022-11-25 CN disclosed
EP-3760657-A1 HYDROPHILIZING AGENT FOR PRODUCTION OF SELF-EMULSIFYING POLYISOCYANATE COMPOSITION, SELF-EMULSIFYING POLYISOCYANATE COMPOSITION, COATING MATERIAL COMPOSITION, AND COATING FILM Tosoh Corporation (JP) 2021-01-06 EP disclosed
US-20200399420-A1 HYDROPHILIZING AGENT FOR PRODUCTION OF SELF-EMULSIFYING POLYISOCYANATE COMPOSITION, SELF-EMULSIFYING POLYISOCYANATE COMPOSITION, COATING MATERIAL COMPOSITION, AND COATING FILM TOSOH CORPORATION (JP) 2020-12-24 US disclosed