SCHEMBL20352837

SCHEMBL20352837

COc1ccnc(C(=S)N[C@@H](C)C(=O)OC(C)[C@H](c2ccccc2)C2CCCC2)c1OC(C)=O

nearest known ligand 0.34

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ TSHR P16473 1/20 0.34
▸ ALK Q9UM73 2/20 0.34
▸ IGF1R P08069 1/20 0.34
▸ ALDH1A1 P00352 2/20 0.33
▸ KMT2A Q03164 2/20 0.33
▸ MEN1 O00255 1/20 0.33
▸ MAPK1 P28482 1/20 0.33
▸ NPSR1 Q6W5P4 1/20 0.32
▸ TACR1 P25103 1/20 0.32
▸ MET P08581 1/20 0.32
▸ EPHX1 P07099 2/20 0.31
▸ LMNA P02545 1/20 0.31
▸ AGTR2 P50052 1/20 0.31
▸ POLB P06746 1/20 0.31
▸ RECQL P46063 1/20 0.31
▸ KDM4E B2RXH2 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
SCHEMBL20352659 1.00 TSHR (0.34) TSHRALKIGF1RALDH1A1KMT2A
SCHEMBL29443131 1.00 TSHR (0.34) TSHRALKIGF1RALDH1A1KMT2A
SCHEMBL20352740 0.92 ALDH1A1 (0.35) TSHRALKIGF1RALDH1A1KMT2A
SCHEMBL20352972 0.92 ALDH1A1 (0.35) TSHRALKIGF1RALDH1A1KMT2A
SCHEMBL25021283 0.89 ALDH1A1 (0.33) ALDH1A1KMT2AMAPK1NPSR1
SCHEMBL21339315 0.89 ALDH1A1 (0.33) ALDH1A1KMT2AMAPK1NPSR1
SCHEMBL20352628 0.88 ALDH1A1 (0.35) ALKIGF1RALDH1A1KMT2AMEN1
SCHEMBL20352650 0.88 ALDH1A1 (0.35) ALKIGF1RALDH1A1KMT2AMEN1
SCHEMBL29443149 0.88 ALDH1A1 (0.35) ALKIGF1RALDH1A1KMT2AMEN1
SCHEMBL20352830 0.83 MEN1 (0.34) TSHRALKIGF1RALDH1A1KMT2A

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 6 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
US-10246417-B2 Picolinamides as fungicides DOW AGROSCIENCES LLC (US) 2019-04-02 — — US disclosed
WO-2018129237-A1 PICOLINAMIDES AS FUNGICIDES DOW AGROSCIENCES LLC (US) 2018-07-12 — — WO disclosed
WO-2018129238-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 TSHR 2350/4885ALK 1886/4885IGF1R 2485/4885
US-10246417-B2 Picolinamides as fungicides CYP1A2, CYP4F12, FKBP2 TSHR 2350/4885ALK 1886/4885IGF1R 2485/4885
US-20180186742-A1 PICOLINAMIDES AS FUNGICIDES CYP1A2, CYP4F12, FKBP2 TSHR 2350/4885ALK 1886/4885IGF1R 2485/4885

“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.

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