SCHEMBL10187600

SCHEMBL10187600

Cc1cc(Oc2ccc(Cl)cc2F)cc(C)c1C1=C(O)[C@H]2[C@@H](C1=O)[C@@H]1CC[C@H]2O1

nearest known ligand 0.38

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
HTR2C P28335 1/20 0.38
HTR2B P41595 1/20 0.38
SCN9A Q15858 4/20 0.33
SLC6A4 P31645 3/20 0.33
FPR2 P25090 2/20 0.33
KCNH2 Q12809 2/20 0.33
HTR2A P28223 1/20 0.33
PTGS2 P35354 4/20 0.32
PTGS1 P23219 1/20 0.32
SLC6A2 P23975 2/20 0.32
SLC6A3 Q01959 1/20 0.32
HIF1A Q16665 1/20 0.32
USP30 Q70CQ3 1/20 0.31
BRAF P15056 1/20 0.31
KDR P35968 1/20 0.31
MET P08581 2/20 0.31
SCN8A Q9UQD0 1/20 0.31
SCN10A Q9Y5Y9 1/20 0.31
EPAS1 Q99814 1/20 0.31

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
SCHEMBL10187599 0.90 BRD4 (0.36) PTGS2
SCHEMBL10187528 0.88 PTGS2 (0.32) KCNH2PTGS2PTGS1
SCHEMBL13261982 0.88
SCHEMBL10187597 0.87 L3MBTL1 (0.34) SLC6A4SLC6A2SLC6A3
SCHEMBL10187604 0.86 BACE1 (0.32) HIF1A
SCHEMBL10187596 0.86 SCN9A (0.32) SCN9A
SCHEMBL10187603 0.83 TTK (0.34) SLC6A4SLC6A2HIF1A
SCHEMBL16281713 0.83 TTK (0.34) SLC6A4SLC6A2HIF1A
SCHEMBL10187605 0.83 LDHA (0.38)
SCHEMBL10187611 0.83 NAAA (0.35)

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
EP-2393769-B1 NOVEL HERBICIDES SYNGENTA LTD (GB) 2014-12-10 EP disclosed
US-8680339-B2 Herbicides SYNGENTA LIMITED (GB) 2014-03-25 US disclosed
US-8680339-B2 Herbicides SYNGENTA LIMITED (GB) 2014-03-25 US disclosed
US-20120028800-A1 NOVEL HERBICIDES SYNGENTA CROP PROTECTION LLC (US) 2012-02-02 US disclosed
US-20120028800-A1 NOVEL HERBICIDES SYNGENTA CROP PROTECTION LLC (US) 2012-02-02 US disclosed
WO-2010089210-A1 NOVEL HERBICIDES SYNGENTA LIMITED (GB) 2010-08-12 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-20120028800-A1 NOVEL HERBICIDES DDT, CYP4X1, CYP1B1 HTR2C 565/4885HTR2B 989/4885SCN9A 2224/4885

“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.