SCHEMBL10196265

SCHEMBL10196265

CCc1ccc(Oc2ncc(C(F)(F)F)cc2F)cc1C1=C(O)C2C(C1=O)[C@H]1CC[C@@H]2CC1

nearest known ligand 0.38

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
SCN9A Q15858 1/20 0.38
LMNA P02545 2/20 0.35
HCRTR1 O43613 10/20 0.34
RAB9A P51151 1/20 0.34
SMN1; SMN2 Q16637 2/20 0.34
KDR P35968 1/20 0.34
ALDH1A1 P00352 1/20 0.33
FFAR1 O14842 1/20 0.32

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
SCHEMBL19071593 1.00 SCN9A (0.38) SCN9ALMNAHCRTR1RAB9ASMN1; SMN2
SCHEMBL10196278 0.91 LMNA (0.35) SCN9ALMNARAB9ASMN1; SMN2ALDH1A1
SCHEMBL19071204 0.90 RAB9A (0.46) SCN9ALMNARAB9ASMN1; SMN2ALDH1A1
SCHEMBL10196258 0.90 RAB9A (0.46) SCN9ALMNARAB9ASMN1; SMN2ALDH1A1
SCHEMBL19070966 0.89 SCN9A (0.37) SCN9ALMNAHCRTR1RAB9ASMN1; SMN2
SCHEMBL10196313 0.89 SCN9A (0.37) SCN9ALMNAHCRTR1RAB9ASMN1; SMN2
SCHEMBL19070614 0.88 BACE1 (0.37)
SCHEMBL10196081 0.88 BACE1 (0.37)
SCHEMBL19070965 0.86 MAPK1 (0.44) SCN9ALMNAFFAR1
SCHEMBL10196256 0.86 MAPK1 (0.44) SCN9ALMNAFFAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2389066-B1 CYCLOPENTADIONE DERIVED HERBICIDES SYNGENTA LTD (GB) 2017-07-05 EP disclosed
US-8895474-B2 Herbicidally active cyclopentanediones and derivatives thereof, and their use in controlling weeds SYNGENTA LIMITED (GB) 2014-11-25 US disclosed
US-8895474-B2 Herbicidally active cyclopentanediones and derivatives thereof, and their use in controlling weeds SYNGENTA LIMITED (GB) 2014-11-25 US disclosed
US-20120021912-A1 NOVEL HERBICIDES SYNGENTA CROP PROTECTION LLC (US) 2012-01-26 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 (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-20120021912-A1 NOVEL HERBICIDES DDT, CYP4X1, CYP1B1 SCN9A 2224/4885LMNA 4657/4885HCRTR1 54/4885

“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.