SCHEMBL13041556

SCHEMBL13041556

CCC1(C)OC(C)(C)C(=O)C(c2nc(-c3ccc(Cl)cc3)sc2C)C1=O

nearest known ligand 0.40

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ GAA P10253 1/20 0.37
▸ MAPT P10636 2/20 0.36
▸ TRPM8 Q7Z2W7 1/20 0.36
▸ HRH3 Q9Y5N1 6/20 0.36
▸ RAB9A P51151 2/20 0.35
▸ SMN1; SMN2 Q16637 2/20 0.35
▸ KDM4E B2RXH2 1/20 0.35
▸ NPC1 O15118 1/20 0.35
▸ POLB P06746 1/20 0.35
▸ ALDH1A1 P00352 2/20 0.35
▸ KMT2A Q03164 2/20 0.35
▸ MEN1 O00255 1/20 0.35
▸ APEX1 P27695 1/20 0.34
▸ LMNA P02545 2/20 0.33
▸ CASP3 P42574 1/20 0.33
▸ SENP8 Q96LD8 1/20 0.33
▸ SENP7 Q9BQF6 1/20 0.33
▸ SENP6 Q9GZR1 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
SCHEMBL13041400 0.90 RAB9A (0.40) GAAMAPTTRPM8HRH3RAB9A
SCHEMBL2762937 0.80 HRH3 (0.41) GAAMAPTTRPM8HRH3RAB9A
SCHEMBL13041360 0.79 RAB9A (0.41) GAAMAPTTRPM8HRH3RAB9A
SCHEMBL2762944 0.79 RAB9A (0.41) GAAMAPTTRPM8HRH3RAB9A
SCHEMBL13041406 0.78 NPC1 (0.36) MAPTKDM4ENPC1
SCHEMBL13041486 0.78 PPARA (0.31) GAAMAPTKDM4EALDH1A1KMT2A
SCHEMBL13041424 0.77 KDM4E (0.38) MAPTRAB9AKDM4ENPC1POLB
SCHEMBL13041410 0.77 PIK3CD (0.40) MAPTHRH3KDM4EPOLBALDH1A1
SCHEMBL13041408 0.76 MEN1 (0.33) ALDH1A1KMT2AMEN1CASP3
SCHEMBL13041527 0.76 IKBKB (0.33) —

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
US-8956999-B2 Herbicides SYNGENTA LIMITED (GB) 2015-02-17 — — US disclosed
US-8956999-B2 Herbicides SYNGENTA LIMITED (GB) 2015-02-17 — — US disclosed
EP-2173727-B1 NOVEL HERBICIDES SYNGENTA LTD (GB) 2013-11-06 — — EP disclosed
US-20100279868-A1 NOVEL HERBICIDES SYNGENTA CROP PROTECTION, INC. (US) 2010-11-04 — — US disclosed
US-20100279868-A1 NOVEL HERBICIDES SYNGENTA CROP PROTECTION, INC. (US) 2010-11-04 — — US disclosed
WO-2009000533-A1 NOVEL HERBICIDES SYNGENTA LIMITED (GB) 2008-12-31 — — 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-20100279868-A1 NOVEL HERBICIDES DDT, HPD, HSD17B1 GAA 2787/4885MAPT 3291/4885TRPM8 2954/4885

“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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