SCHEMBL653624

SCHEMBL653624

CCCCC/C=C\C/C=C\CCCCCCCC(=O)NC(C)O

nearest known ligand 0.74

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.68
SMN1; SMN2 Q16637 1/20 0.68
KCNK3 O14649 1/20 0.68
THRB P10828 1/20 0.68
CNR2 P34972 1/20 0.68
BLM P54132 1/20 0.68
TDP1 Q9NUW8 1/20 0.68
SLC6A5 Q9Y345 1/20 0.68
ASAH2 Q9NR71 1/20 0.63
MEN1 O00255 1/20 0.62
KMT2A Q03164 1/20 0.62
CNR1 P21554 2/20 0.61
HPGD P15428 1/20 0.61
TRPV1 Q8NER1 1/20 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
SCHEMBL11872018 1.00 ALDH1A1 (0.68) ALDH1A1SMN1; SMN2KCNK3THRBCNR2
SCHEMBL5682652 1.00 ALDH1A1 (0.68) ALDH1A1SMN1; SMN2KCNK3THRBCNR2
SCHEMBL5145799 1.00 ALDH1A1 (0.68) ALDH1A1SMN1; SMN2KCNK3THRBCNR2
SCHEMBL375483 0.95 CNR2 (0.74) ALDH1A1SMN1; SMN2KCNK3THRBCNR2
SCHEMBL5889532 0.95 CNR2 (0.74) ALDH1A1SMN1; SMN2KCNK3THRBCNR2
SCHEMBL9109309 0.95 ASAH2 (0.68) ALDH1A1SMN1; SMN2KCNK3THRBCNR2
SCHEMBL6846748 0.95 ASAH2 (0.68) ALDH1A1SMN1; SMN2KCNK3THRBCNR2
SCHEMBL1147692 0.95 ASAH2 (0.68) ALDH1A1SMN1; SMN2KCNK3THRBCNR2
SCHEMBL2225404 0.95 ASAH2 (0.68) ALDH1A1SMN1; SMN2KCNK3THRBCNR2
SCHEMBL11867138 0.91 ALDH1A1 (0.59) ALDH1A1SMN1; SMN2KCNK3THRBCNR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116102914-A Environment-friendly water-borne wood coating gloss regulator and preparation method thereof 贵州正业龙腾新材料开发有限公司 2023-05-12 CN claimed
CN-116102914-A Environment-friendly water-borne wood coating gloss regulator and preparation method thereof 贵州正业龙腾新材料开发有限公司 2023-05-12 CN disclosed
CN-109875963-B Ceftriaxone sodium injection and preparation method thereof 上海欣峰制药有限公司 2021-03-30 CN disclosed
CN-111356755-A Fuel-efficient passenger car lubricating oil composition 雪佛龙日本有限公司 2020-06-30 CN disclosed
EP-1969106-B2 LIQUID NONIONIC SURFACTANTS FOR EMULSION POLYMERIZATION AND OTHER APPLICATIONS INNOSPEC PERFORMANCE CHEMICALS EUROPE LTD (GB) 2020-04-22 EP disclosed
EP-1969106-B1 LIQUID NONIONIC SURFACTANTS FOR EMULSION POLYMERIZATION AND OTHER APPLICATIONS INNOSPEC PERFORMANCE CHEMICALS EUROPE LTD (GB) 2017-03-15 EP disclosed
US-8119585-B2 Liquid nonionic surfactants for emulsion polymerization and other applications HUNTSMAN INTERNATIONAL LLC (US) 2012-02-21 US disclosed
US-20100216744-A1 THICKENER/GELLANT FOR OILY SUBSTANCE MIZUTANI GENZO 2010-08-26 US disclosed
EP-2208769-A1 THICKENER/GELLANT FOR OILY SUBSTANCE Mizutani, Genzo (JP) 2010-07-21 EP disclosed
US-20080293914-A1 Liquid Nonionic Surfactants for Emulsion Polymerization and Other Applications INNOSPEC PERFORMANCE CHEMICALS EUROPE LIMITED (GB) 2008-11-27 US disclosed
EP-1969106-A2 LIQUID NONIONIC SURFACTANTS FOR EMULSION POLYMERIZATION AND OTHER APPLICATIONS Huntsman International LLC (US) 2008-09-17 EP disclosed
WO-2007064673-A2 LIQUID NONIONIC SURFACTANTS FOR EMULSION POLYMERIZATION AND OTHER APPLICATIONS HUNTSMAN INTERNATIONAL LLC (US) 2007-06-07 WO disclosed
US-4039562-A MALEIC ANHYDRIDE, FATTY ALCOHOL, ALKALI METAL SULFITE REWO CHEMISCHE WERKE G.M.B.H. (DT) 1977-08-02 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20100216744-A1 THICKENER/GELLANT FOR OILY SUBSTANCE GPR55, MKI67, SLC43A1 ALDH1A1 1048/4885SMN1; SMN2 4588/4885KCNK3 683/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.