SCHEMBL20348321

SCHEMBL20348321

CC(OC(=O)[C@H](C)N)[C@H](c1ccccc1)C1CCCC1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TSHR P16473 2/20 0.41
▸ IDO1 P14902 3/20 0.41
▸ CYP3A4 P08684 3/20 0.41
▸ LMNA P02545 3/20 0.41
▸ EPHX1 P07099 2/20 0.41
▸ HPGD P15428 1/20 0.41
▸ CYP2C19 P33261 1/20 0.41
▸ RAB9A P51151 1/20 0.41
▸ CHRM2 P08172 1/20 0.41
▸ HTR1A P08908 1/20 0.41
▸ ADRA2A P08913 1/20 0.41
▸ CHRM1 P11229 1/20 0.41
▸ DRD1 P21728 1/20 0.41
▸ SLC6A2 P23975 1/20 0.41
▸ ADRA1A P35348 1/20 0.41
▸ OPRM1 P35372 1/20 0.41
▸ DRD3 P35462 1/20 0.41
▸ SLC6A3 Q01959 1/20 0.41
▸ KCNH2 Q12809 1/20 0.41
▸ CYP1A2 P05177 1/20 0.41

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
SCHEMBL20348312 1.00 TSHR (0.41) TSHRIDO1CYP3A4LMNAEPHX1
SCHEMBL20348315 0.82 CHRNA1 (0.36) SLC6A2SLC6A3MEN1KMT2AMETAP2
SCHEMBL20370143 0.82 CYP3A4 (0.45) TSHRCYP3A4LMNAEPHX1HPGD
SCHEMBL20348319 0.81 SLC6A3 (0.39) SLC6A2SLC6A3KCNH2MAPT
SCHEMBL17904819 0.78 METAP2 (0.43) TSHRIDO1LMNAHPGDRAB9A
SCHEMBL17905611 0.77 METAP2 (0.45) TSHRIDO1LMNAHPGDRAB9A
SCHEMBL20352935 0.77 CTSK (0.41) LMNAEPHX1MEN1KMT2AMAPT
SCHEMBL20352943 0.77 CTSK (0.41) LMNAEPHX1MEN1KMT2AMAPT
SCHEMBL20682901 0.76 METAP2 (0.43) TSHRIDO1LMNAHPGDRAB9A
SCHEMBL17901133 0.76 METAP2 (0.43) TSHRIDO1LMNAHPGDRAB9A

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 7 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-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-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 2350/4885IDO1 582/4885CYP3A4 79/4885
US-10246417-B2 Picolinamides as fungicides CYP1A2, CYP4F12, FKBP2 TSHR 2350/4885IDO1 582/4885CYP3A4 79/4885
US-20180186742-A1 PICOLINAMIDES AS FUNGICIDES CYP1A2, CYP4F12, FKBP2 TSHR 2350/4885IDO1 582/4885CYP3A4 79/4885

“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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