SCHEMBL19137606

SCHEMBL19137606

CC(CSCC#N)NC(=O)O

nearest known ligand 0.37

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ MMP1 P03956 1/20 0.37
▸ SMN1; SMN2 Q16637 1/20 0.36
▸ MTNR1A P48039 3/20 0.33
▸ MTNR1B P49286 3/20 0.33
▸ ALDH1A1 P00352 2/20 0.33
▸ KMT2A Q03164 2/20 0.33
▸ RECQL P46063 1/20 0.33
▸ CTSL P07711 3/20 0.31
▸ CTSS P25774 2/20 0.31
▸ CTSK P43235 2/20 0.31
▸ CTSB P07858 1/20 0.31
▸ MEN1 O00255 1/20 0.30

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
SCHEMBL19137604 1.00 MMP1 (0.37) MMP1SMN1; SMN2MTNR1AMTNR1BALDH1A1
SCHEMBL19137472 0.82 ALDH1A1 (0.35) MTNR1AMTNR1BALDH1A1CTSLCTSS
SCHEMBL19137473 0.82 ALDH1A1 (0.35) MTNR1AMTNR1BALDH1A1CTSLCTSS
SCHEMBL21096338 0.80 ESR1 (0.36) MMP1CTSSCTSK
SCHEMBL19170615 0.77 CTSS (0.50) CTSLCTSSCTSKCTSB
SCHEMBL3060277 0.77 MTNR1A (0.35) MTNR1AMTNR1BKMT2AMEN1
SCHEMBL19136351 0.76 METAP2 (0.41) MTNR1AMTNR1BALDH1A1KMT2AMEN1
SCHEMBL19136412 0.76 MTNR1A (0.37) MMP1MTNR1AMTNR1BALDH1A1
SCHEMBL4322486 0.74 — —
SCHEMBL16648848 0.74 — —

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
EP-3407720-B1 MOLECULES HAVING PESTICIDAL UTILITY, AND INTERMEDIATES, COMPOSITIONS, AND PROCESSES, RELATED THERETO DOW AGROSCIENCES LLC (US) 2021-03-10 — — EP disclosed
US-10681908-B2 Molecules having pesticidal utility, and intermediates, compositions, and processes, related thereto DOW AGROSCIENCES LLC (US) 2020-06-16 — — US disclosed
US-20170208806-A1 MOLECULES HAVING PESTICIDAL UTILITY, AND INTERMEDIATES, COMPOSITIONS, AND PROCESSES, RELATED THERETO DOW AGROSCIENCES LLC (US) 2017-07-27 — — 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 (2 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-10681908-B2 Molecules having pesticidal utility, and intermediates, compositions, and processes, related thereto ACHE, DDT, MSMO1 MMP1 1773/4885SMN1; SMN2 3681/4885MTNR1A 2214/4885
US-20170208806-A1 MOLECULES HAVING PESTICIDAL UTILITY, AND INTERMEDIATES, COMPOSITIONS, AND PROCESSES, RELATED THERETO ACHE, DDT, MSMO1 MMP1 1773/4885SMN1; SMN2 3681/4885MTNR1A 2214/4885

“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