SCHEMBL2442963

SCHEMBL2442963

[CH2]CCCCCCC/C=C\CCCCCCCCC(C)(O)O

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACLY P53396 1/20 0.47
FABP3 P05413 7/20 0.33
FAAH O00519 3/20 0.31
CES1 P23141 2/20 0.31
GMNN O75496 1/20 0.31
USP2 O75604 1/20 0.31
LMNA P02545 1/20 0.31
CYP1A2 P05177 1/20 0.31
POLB P06746 1/20 0.31
MAPT P10636 1/20 0.31
CYP2C9 P11712 1/20 0.31
ALOX15 P16050 1/20 0.31
APEX1 P27695 1/20 0.31
CYP2C19 P33261 1/20 0.31
RECQL P46063 1/20 0.31
BLM P54132 1/20 0.31
NPSR1 Q6W5P4 1/20 0.31
HSD17B10 Q99714 1/20 0.31
DUSP3 P51452 1/20 0.31
MMP2 P08253 1/20 0.31

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
SCHEMBL2032636 0.87 ALDH1A1 (0.33)
SCHEMBL6443566 0.87 ALDH1A1 (0.33)
SCHEMBL3296074 0.87 ALDH1A1 (0.33)
SCHEMBL27607436 0.84
SCHEMBL17713596 0.79 ACLY (0.47) ACLYFABP3FAAHLMNACYP1A2
SCHEMBL5987552 0.76 FAAH (0.38) ACLYFAAHGMNNUSP2LMNA
SCHEMBL5985260 0.76 FAAH (0.38) ACLYFAAHGMNNUSP2LMNA
SCHEMBL5985378 0.76 FAAH (0.38) ACLYFAAHGMNNUSP2LMNA
SCHEMBL5984457 0.76 FAAH (0.38) ACLYFAAHGMNNUSP2LMNA
SCHEMBL5984929 0.76 FAAH (0.38) ACLYFAAHGMNNUSP2LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170275569-A1 HAND DISHWASHING DETERGENT HAVING AN IMPROVED EFFECT AGAINST STARCH HENKEL AG & CO. KGAA (DE) 2017-09-28 US disclosed
US-20110300080-A1 ACIDIFIED CHLORITE DISINFECTANT COMPOSITIONS WITH OLEFIN STABILIZERS ECOLAB USA INC. (US) 2011-12-08 US disclosed
US-8021694-B2 Acidified chlorite disinfectant compositions with olefin stabilizers ECOLAB USA INC. (US) 2011-09-20 US disclosed
WO-2008046778-A1 MANUAL DISHWASHING DETERGENT WITH IMPROVED OIL SOLUBILIZATION HENKEL AG & CO. KGAA (DE) 2008-04-24 WO disclosed
EP-1737939-A1 TEXTILE CARE PRODUCT Henkel Kommanditgesellschaft auf Aktien (DE) 2007-01-03 EP disclosed
WO-2005103219-A1 TEXTILE CARE PRODUCT HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 2005-11-03 WO disclosed
US-20050184273-A1 Acidified chlorite disinfectant compositions with olefin stabilizers ECOLAB INC. (US) 2005-08-25 US disclosed
US-6861397-B2 Compositions having enhanced deposition of a topically active compound on a surface THE DIAL CORPORATION (US) 2005-03-01 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-20110300080-A1 ACIDIFIED CHLORITE DISINFECTANT COMPOSITIONS WITH OLEFIN STABILIZERS HAO2, AOC1, AOC2 ACLY 1762/4885FABP3 4292/4885FAAH 61/4885

“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.