SCHEMBL17900665

SCHEMBL17900665

Cc1ccc([C@@H](Oc2ccc(C)cc2Cl)[C@H](C)OC(=O)[C@H](C)N)cc1

nearest known ligand 0.40

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ TAS1R3 Q7RTX0 1/20 0.40
▸ TAS1R1 Q7RTX1 1/20 0.40
▸ RORC P51449 3/20 0.35
▸ NPSR1 Q6W5P4 1/20 0.35
▸ MRGPRX4 Q96LA9 1/20 0.34
▸ SMN1; SMN2 Q16637 2/20 0.33
▸ KDM4E B2RXH2 1/20 0.33
▸ NPC1 O15118 1/20 0.33
▸ HPGD P15428 1/20 0.33
▸ RAB9A P51151 1/20 0.33
▸ MEN1 O00255 1/20 0.33
▸ KMT2A Q03164 1/20 0.33
▸ TDP1 Q9NUW8 1/20 0.33
▸ KMO O15229 1/20 0.33
▸ CSNK2A1 P68400 1/20 0.33

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
SCHEMBL17900563 0.93 TAS1R3 (0.35) TAS1R3TAS1R1RORCNPSR1MRGPRX4
SCHEMBL17900631 0.93 RORC (0.43) TAS1R3TAS1R1RORCMRGPRX4KDM4E
SCHEMBL17900560 0.85 TAS1R3 (0.38) TAS1R3TAS1R1NPSR1MRGPRX4HPGD
SCHEMBL17900663 0.82 PPARA (0.48) RORCSMN1; SMN2KDM4EHPGDMEN1
SCHEMBL17900769 0.82 PPARA (0.48) RORCSMN1; SMN2KDM4EHPGDMEN1
SCHEMBL17905560 0.81 RORC (0.35) TAS1R3TAS1R1RORCNPSR1MRGPRX4
SCHEMBL20682908 0.80 RORC (0.36) TAS1R3TAS1R1RORCNPSR1MRGPRX4
SCHEMBL17901053 0.80 RORC (0.36) TAS1R3TAS1R1RORCNPSR1MRGPRX4
SCHEMBL17905522 0.80 NPSR1 (0.39) TAS1R3TAS1R1RORCNPSR1MRGPRX4
SCHEMBL17900564 0.80 TAS1R3 (0.35) TAS1R3TAS1R1SMN1; SMN2NPC1RAB9A

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-3255991-B1 PICOLINAMIDES AS FUNGICIDES DOW AGROSCIENCES LLC (US) 2020-09-30 — — EP disclosed
US-10173981-B2 Picolinamides as fungicides DOW AGROSCIENCES LLC (US) 2019-01-08 — — US disclosed
US-20180002288-A1 USE OF PICOLINAMIDES AS FUNGICIDES CORTEVA AGRISCIENCE LLC 2018-01-04 — — US disclosed
US-20180000080-A1 PICOLINAMIDES AS FUNGICIDES CORTEVA AGRISCIENCE LLC 2018-01-04 — — US disclosed
WO-2016109305-A1 USE OF PICOLINAMIDES AS FUNGICIDES DOW AGROSCIENCES LLC (US) 2016-07-07 — — WO disclosed
WO-2016109304-A1 PICOLINAMIDES AS FUNGICIDES DOW AGROSCIENCES LLC (US) 2016-07-07 — — WO 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-20180000080-A1 PICOLINAMIDES AS FUNGICIDES CYP1A2, CYP4F12, FKBP2 TAS1R3 1246/4885TAS1R1 1444/4885RORC 1184/4885
US-20180002288-A1 USE OF PICOLINAMIDES AS FUNGICIDES PFAS, CYP1A2, CYP4F12 TAS1R3 1121/4885TAS1R1 1325/4885RORC 1922/4885
US-10173981-B2 Picolinamides as fungicides CYP1A2, CYP4F12, FKBP2 TAS1R3 1246/4885TAS1R1 1444/4885RORC 1184/4885

“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