SCHEMBL4089901

SCHEMBL4089901

COC(C)=C(C(=O)O)c1ccccc1COc1cc(C(F)(F)F)nc(OC(C)C)n1

nearest known ligand 0.36

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PTGS1 P23219 1/20 0.36
PTGS2 P35354 1/20 0.36
OPRL1 P41146 5/20 0.36
EDNRB P24530 1/20 0.35
EDNRA P25101 1/20 0.35
HIF1A Q16665 2/20 0.34
RXRA P19793 1/20 0.34
RXRB P28702 1/20 0.34
PPARG P37231 1/20 0.34
CYP1A2 P05177 1/20 0.33
MRGPRX4 Q96LA9 1/20 0.33
SYK P43405 1/20 0.33
SDHB P21912 1/20 0.32
HSD17B10 Q99714 1/20 0.32
IGF1R P08069 2/20 0.32
KDM4E B2RXH2 1/20 0.32
MAPK1 P28482 1/20 0.32

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
SCHEMBL5999116 0.93 HIF1A (0.38) PTGS1PTGS2OPRL1EDNRBEDNRA
SCHEMBL23960154 0.87 PTGS1 (0.38) PTGS1PTGS2OPRL1EDNRBEDNRA
SCHEMBL3110532 0.84 PTGS1 (0.36) PTGS1PTGS2OPRL1EDNRBEDNRA
SCHEMBL3110515 0.84 PTGS1 (0.36) PTGS1PTGS2OPRL1EDNRBEDNRA
SCHEMBL5997735 0.83 HIF1A (0.39) PTGS1PTGS2OPRL1EDNRBEDNRA
SCHEMBL5998920 0.82 HIF1A (0.38) PTGS1PTGS2OPRL1EDNRBEDNRA
SCHEMBL5997731 0.82 HIF1A (0.38) PTGS1PTGS2OPRL1EDNRBEDNRA
Fluacrypyrim SCHEMBL5997532 0.81 HIF1A (0.37) PTGS1PTGS2OPRL1EDNRBEDNRA
Fluacrypyrim SCHEMBL29413955 0.81 HIF1A (0.37) PTGS1PTGS2OPRL1EDNRBEDNRA
Fluacrypyrim SCHEMBL682688 0.81 HIF1A (0.37) PTGS1PTGS2OPRL1EDNRBEDNRA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090186762-A1 METHOD FOR IMPROVING THE TOLERANCE OF PLANTS TO CHILLING TEMPERATURES AND/OR FROST BASF SE (DE) 2009-07-23 US disclosed
US-20040067853-A1 Sulfonamide derivative-containing agricultural and horticultural composition NAKAYAMA MASAHARU (JP) 2004-04-08 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 (2 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-20040067853-A1 Sulfonamide derivative-containing agricultural and horticultural composition NAT1, NR4A1, MRM1 PTGS1 1933/4885PTGS2 2987/4885OPRL1 1622/4885
US-20090186762-A1 METHOD FOR IMPROVING THE TOLERANCE OF PLANTS TO CHILLING TEMPERATURES AND/OR FROST UQCRC1, UQCRC2, CYC1 PTGS1 1113/4885PTGS2 1465/4885OPRL1 4358/4885

“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.