SCHEMBL20336532

SCHEMBL20336532

CC(C)C(c1ccc(F)cc1)C(C)OCc1ccccc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 3/20 0.44
▸ KDM4E B2RXH2 1/20 0.44
▸ AOC3 Q16853 1/20 0.42
▸ CNR2 P34972 1/20 0.40
▸ SLC6A4 P31645 5/20 0.40
▸ SLC6A3 Q01959 5/20 0.40
▸ MMP9 P14780 2/20 0.40
▸ MMP8 P22894 2/20 0.40
▸ RCE1 Q9Y256 1/20 0.39
▸ TACR1 P25103 1/20 0.39
▸ CYP3A4 P08684 2/20 0.38
▸ CYP2D6 P10635 2/20 0.38
▸ CYP2C9 P11712 2/20 0.38
▸ CYP2C19 P33261 2/20 0.38
▸ SLC6A2 P23975 2/20 0.38
▸ MEN1 O00255 2/20 0.38
▸ KMT2A Q03164 2/20 0.38
▸ MAPT P10636 2/20 0.37
▸ NPC1 O15118 1/20 0.37
▸ LMNA P02545 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
SCHEMBL20336531 1.00 ALDH1A1 (0.44) ALDH1A1KDM4EAOC3CNR2SLC6A4
SCHEMBL20336549 1.00 ALDH1A1 (0.44) ALDH1A1KDM4EAOC3CNR2SLC6A4
SCHEMBL22040557 0.84 ALDH1A1 (0.43) ALDH1A1KDM4ECNR2SLC6A4SLC6A3
SCHEMBL17894178 0.84 ALDH1A1 (0.43) ALDH1A1KDM4ECNR2SLC6A4SLC6A3
SCHEMBL20336627 0.81 RCE1 (0.45) ALDH1A1KDM4ECNR2SLC6A4SLC6A3
SCHEMBL20336625 0.81 RCE1 (0.45) ALDH1A1KDM4ECNR2SLC6A4SLC6A3
SCHEMBL21587147 0.76 IDO1 (0.48) ALDH1A1MEN1KMT2ALMNA
SCHEMBL20463639 0.75 RCE1 (0.49) ALDH1A1AOC3SLC6A4SLC6A3MMP9
SCHEMBL5018878 0.75 RCE1 (0.49) ALDH1A1AOC3SLC6A4SLC6A3MMP9
SCHEMBL20837594 0.75 SLC6A4 (0.45) ALDH1A1KDM4ESLC6A4SLC6A3CYP3A4

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
EP-3565410-B1 PICOLINAMIDES AS FUNGICIDES CORTEVA AGRISCIENCE LLC (US) 2023-02-15 — — EP disclosed
CN-110352006-B Picolinamides as fungicides 美国陶氏益农公司 2022-02-18 — — CN disclosed
EP-3565410-A1 PICOLINAMIDES AS FUNGICIDES Dow AgroSciences LLC (US) 2019-11-13 — — EP disclosed
US-10246417-B2 Picolinamides as fungicides DOW AGROSCIENCES LLC (US) 2019-04-02 — — US disclosed
WO-2018129238-A1 PICOLINAMIDES AS FUNGICIDES DOW AGROSCIENCES LLC (US) 2018-07-12 — — WO disclosed
WO-2018129237-A1 PICOLINAMIDES AS FUNGICIDES DOW AGROSCIENCES LLC (US) 2018-07-12 — — WO disclosed
US-20180186742-A1 PICOLINAMIDES AS FUNGICIDES DOW AGROSCIENCES LLC (US) 2018-07-05 — — US disclosed
US-20180186743-A1 PICOLINAMIDES AS FUNGICIDES DOW AGROSCIENCES LLC (US) 2018-07-05 — — 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 (3 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-20180186743-A1 PICOLINAMIDES AS FUNGICIDES CYP1A2, CYP4F12, FKBP2 ALDH1A1 1130/4885KDM4E 2568/4885AOC3 1260/4885
US-10246417-B2 Picolinamides as fungicides CYP1A2, CYP4F12, FKBP2 ALDH1A1 1130/4885KDM4E 2568/4885AOC3 1260/4885
US-20180186742-A1 PICOLINAMIDES AS FUNGICIDES CYP1A2, CYP4F12, FKBP2 ALDH1A1 1130/4885KDM4E 2568/4885AOC3 1260/4885

“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.

Send feedback