SCHEMBL3910254

SCHEMBL3910254

CC(C)Oc1cccc(NC(=O)c2cscc2C(F)(F)F)c1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KCNK3 O14649 5/20 0.52
KCNK9 Q9NPC2 5/20 0.52
RXFP1 Q9HBX9 2/20 0.50
MEN1 O00255 1/20 0.49
ALDH1A1 P00352 1/20 0.49
GAA P10253 1/20 0.49
MAPT P10636 1/20 0.49
ALOX12 P18054 1/20 0.49
CCR6 P51684 1/20 0.49
KMT2A Q03164 1/20 0.49
F2 P00734 1/20 0.46
PLG P00747 1/20 0.46
PLAU P00749 1/20 0.46
PLAT P00750 1/20 0.46
KLKB1 P03952 1/20 0.46
PRSS1 P07477 1/20 0.46
PTGS1 P23219 1/20 0.45
NPC1 O15118 1/20 0.45
RAB9A P51151 1/20 0.45
CA2 P00918 1/20 0.45

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
Flutolanil SCHEMBL8362549 0.84 KCNK3 (0.65) KCNK3KCNK9RXFP1MEN1ALDH1A1
Flutolanil SCHEMBL29451184 0.84 KCNK3 (0.65) KCNK3KCNK9RXFP1MEN1ALDH1A1
Flutolanil SCHEMBL18555 0.84 KCNK3 (0.65) KCNK3KCNK9RXFP1MEN1ALDH1A1
SCHEMBL6427225 0.83 MEN1 (0.45) KCNK3KCNK9RXFP1MEN1ALDH1A1
SCHEMBL3984497 0.79 DHODH (0.54) KCNK3KCNK9MEN1ALDH1A1GAA
Flutolanil SCHEMBL18222334 0.79 KCNK3 (0.59) KCNK3KCNK9RXFP1MEN1ALDH1A1
SCHEMBL3919538 0.79 KCNK3 (0.52) KCNK3KCNK9RXFP1MEN1ALDH1A1
SCHEMBL21652267 0.75 KCNK3 (0.56) KCNK3KCNK9RXFP1MEN1ALDH1A1
SCHEMBL1381483 0.74 KCNK3 (0.47) KCNK3KCNK9RXFP1MEN1ALDH1A1
Mepronil SCHEMBL20522512 0.73 KCNK3 (0.67) KCNK3KCNK9MEN1ALDH1A1MAPT

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7501530-B2 Trifluoromethyl-thiophene carboxylic acid aniledes and use thereof as fungicides BASF AKTIENGESELLSCHAFT (DE) 2009-03-10 US disclosed
US-20060172891-A1 Trifluoromethyl-thiophene carboxylic acid aniledes and use thereof as fungicides BASF AKTIENGESELLSCHAFT (DE) 2006-08-03 US disclosed
CN-1764657-A Trifluoromethyl-thiophene carboxylic acid anilides and use thereof as fungicides. BASF AG (DE) 2006-04-26 CN 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 (1 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-20060172891-A1 Trifluoromethyl-thiophene carboxylic acid aniledes and use thereof as fungicides AS3MT, GABBR1, TH KCNK3 4281/4885KCNK9 4327/4885RXFP1 1729/4885

“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.