SCHEMBL19852736

SCHEMBL19852736

C=C[C@@H](O)[C@@H](Cc1ccccc1)C(C)OCc1ccc(OC)cc1

nearest known ligand 0.45

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
RCE1 Q9Y256 1/20 0.45
PPARG P37231 1/20 0.41
PPARA Q07869 1/20 0.41
LTA4H P09960 2/20 0.41
SIGMAR1 Q99720 1/20 0.41
LDHA P00338 1/20 0.40
FFAR1 O14842 1/20 0.40
AOC3 Q16853 1/20 0.40
L3MBTL1 Q9Y468 2/20 0.39
SLC6A4 P31645 1/20 0.39
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
HTT P42858 2/20 0.38
TDP1 Q9NUW8 1/20 0.38
ALDH1A1 P00352 1/20 0.38

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
SCHEMBL16863572 1.00 RCE1 (0.45) RCE1PPARGPPARALTA4HSIGMAR1
SCHEMBL16859407 1.00 RCE1 (0.45) RCE1PPARGPPARALTA4HSIGMAR1
SCHEMBL19852683 1.00 RCE1 (0.45) RCE1PPARGPPARALTA4HSIGMAR1
SCHEMBL16859422 1.00 RCE1 (0.45) RCE1PPARGPPARALTA4HSIGMAR1
SCHEMBL19739505 1.00 RCE1 (0.45) RCE1PPARGPPARALTA4HSIGMAR1
SCHEMBL17417060 0.89 FFAR1 (0.40) PPARGPPARALDHAFFAR1L3MBTL1
SCHEMBL19852656 0.89 FFAR1 (0.40) PPARGPPARALDHAFFAR1L3MBTL1
SCHEMBL28610510 0.89 FFAR1 (0.40) PPARGPPARALDHAFFAR1L3MBTL1
SCHEMBL17892914 0.89 FFAR1 (0.40) PPARGPPARALDHAFFAR1L3MBTL1
SCHEMBL17417013 0.85 LTA4H (0.45) RCE1PPARGPPARALTA4HSIGMAR1

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-3240408-B1 PICOLINAMIDES WITH FUNGICIDAL ACTIVITY DOW AGROSCIENCES LLC (US) 2020-04-08 EP disclosed
US-20190359557-A1 PICOLINAMIDES WITH FUNGICIDAL ACTIVITY DOW AGROSCIENCES LLC (US) 2019-11-28 US disclosed
US-10252989-B2 Picolinamides with fungicidal activity DOW AGROSCIENCES LLC (US) 2019-04-09 US disclosed
US-10173971-B2 Picolinamides with fungicidal activity DOW AGROSCIENCES LLC (US) 2019-01-08 US disclosed
US-20180037541-A1 PICOLINAMIDES WITH FUNGICIDAL ACTIVITY CORTEVA AGRISCIENCE LLC 2018-02-08 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 (4 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-20180037541-A1 PICOLINAMIDES WITH FUNGICIDAL ACTIVITY CYP51A1, CYP1A2, FKBP14 RCE1 313/4885PPARG 2359/4885PPARA 2281/4885
US-20190359557-A1 PICOLINAMIDES WITH FUNGICIDAL ACTIVITY CYP51A1, CYP1A2, FKBP14 RCE1 313/4885PPARG 2359/4885PPARA 2281/4885
US-10173971-B2 Picolinamides with fungicidal activity CYP51A1, CYP1A2, FKBP14 RCE1 313/4885PPARG 2359/4885PPARA 2281/4885
US-10252989-B2 Picolinamides with fungicidal activity CYP51A1, CYP1A2, FKBP14 RCE1 313/4885PPARG 2359/4885PPARA 2281/4885

“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.