SCHEMBL24168239

SCHEMBL24168239

O=C1NC(c2ccc(C(F)(F)F)nc2)CC(O)=C1C(=S)Nc1ccc(F)cc1

nearest known ligand 0.40

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
SLC6A3 Q01959 1/20 0.38
KCNH2 Q12809 1/20 0.38
TAAR1 Q96RJ0 1/20 0.38
ROCK1 Q13464 1/20 0.34
BUB1 O43683 3/20 0.34
TRPV1 Q8NER1 1/20 0.34

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
SCHEMBL26315457 0.91 SLC6A3 (0.37) SLC6A3KCNH2TAAR1BUB1
SCHEMBL30299485 0.89 SLC6A3 (0.44) SLC6A3KCNH2TAAR1ROCK1
SCHEMBL24168453 0.89 SLC6A3 (0.44) SLC6A3KCNH2TAAR1ROCK1
SCHEMBL26313815 0.82 SLC6A3 (0.43) SLC6A3KCNH2TAAR1ROCK1
SCHEMBL25253776 0.81 SLC6A3 (0.43) SLC6A3KCNH2TAAR1ROCK1
SCHEMBL30520430 0.81 SLC6A3 (0.43) SLC6A3KCNH2TAAR1ROCK1
SCHEMBL25251833 0.80 SLC6A3 (0.42) SLC6A3KCNH2TAAR1ROCK1
SCHEMBL30520197 0.80 SLC6A3 (0.42) SLC6A3KCNH2TAAR1ROCK1
SCHEMBL25253944 0.78 SLC6A3 (0.41) SLC6A3KCNH2TAAR1ROCK1
SCHEMBL25796436 0.78 SLC6A3 (0.40) SLC6A3KCNH2TAAR1ROCK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230295108-A1 ARYLTETRAHYDROPYRIDINE DERIVATIVE OR SALT THEREOF, INSECTICIDAL AGENT CONTAINING THE COMPOUND, AND METHOD OF USE THEREOF NIHON NOHYAKU CO., LTD. (JP) 2023-09-21 US disclosed
WO-2021261562-A1 ARYL TETRAHYDROPYRIDINE DERIVATIVE OR SALT THEREOF, INSECTICIDE CONTAINING SAME, AND METHOD FOR USE THEREOF 日本農薬株式会社 2021-12-30 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 (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-20230295108-A1 ARYLTETRAHYDROPYRIDINE DERIVATIVE OR SALT THEREOF, INSECTICIDAL AGENT CONTAINING THE COMPOUND, AND METHOD OF USE THEREOF TRPA1, DDT, HPD SLC6A3 1727/4885KCNH2 83/4885TAAR1 224/4885

“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.