SCHEMBL16334635

SCHEMBL16334635

FC(F)(F)COc1ncccc1I

nearest known ligand 0.41

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
SCN9A Q15858 1/20 0.41
GPBAR1 Q8TDU6 2/20 0.39
KCNH2 Q12809 1/20 0.38
SCN5A Q14524 1/20 0.38
SCN2A Q99250 1/20 0.38
SCN10A Q9Y5Y9 1/20 0.38
HCRTR1 O43613 7/20 0.37
HCRTR2 O43614 7/20 0.37
MAPT P10636 1/20 0.35
ADORA2A P29274 1/20 0.35
PTGS2 P35354 1/20 0.34
SSTR4 P31391 2/20 0.34
CACNA1G O43497 1/20 0.34
CACNA1H O95180 1/20 0.34
SSTR1 P30872 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
SCHEMBL18726968 0.81 SCN9A (0.43) SCN9AGPBAR1KCNH2SCN5ASCN2A
SCHEMBL28080928 0.79 RXRA (0.44) SCN9AGPBAR1KCNH2SCN5ASCN2A
SCHEMBL31143575 0.79 RXRA (0.44) SCN9AGPBAR1KCNH2SCN5ASCN2A
SCHEMBL367912 0.78 L3MBTL1 (0.41) SCN9AGPBAR1KCNH2SCN5ASCN2A
SCHEMBL13424282 0.78 SSTR4 (0.45) SCN9AGPBAR1HCRTR1HCRTR2SSTR4
SCHEMBL16174985 0.78 SSTR4 (0.42) SCN9AGPBAR1KCNH2SCN5ASCN2A
SCHEMBL1933518 0.78 SCN9A (0.41) SCN9AGPBAR1KCNH2SCN5ASCN2A
SCHEMBL11441604 0.78 SCN9A (0.50) SCN9AGPBAR1KCNH2SCN5ASCN2A
SCHEMBL6468236 0.75 SSTR4 (0.46) SCN9AGPBAR1KCNH2SCN5ASCN2A
SCHEMBL6371918 0.75 SSTR4 (0.45) SCN9ASSTR4SSTR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-105392777-B Biaryl derivatives as GPR120 agonists 株式会社LG化学 2020-09-22 CN disclosed
EP-3013796-B9 BIARYL DERIVATIVES AS GPR120 AGONISTS LG CHEMICAL LTD (KR) 2020-07-01 EP disclosed
EP-3628661-A1 BIARYL DERIVATIVES AS GPR120 AGONISTS LG CHEM, LTD. (KR) 2020-04-01 EP disclosed
US-10221138-B2 Biaryl derivatives as GPR120 agonists LG CHEM, LTD. (KR) 2019-03-05 US disclosed
US-20160168096-A1 BIARYL DERIVATIVES AS GPR120 AGONISTS LG LIFE SCIENCES LTD. (KR) 2016-06-16 US disclosed
EP-3013796-A1 BIARYL DERIVATIVES AS GPR120 AGONISTS LG Life Sciences Ltd. (KR) 2016-05-04 EP disclosed
EP-2516445-B1 TRICYCLIC DERIVATIVES AND THEIR PHARMACEUTICAL USE AND COMPOSITIONS CEPHALON INC (US) 2015-03-11 EP disclosed
WO-2014209034-A1 BIARYL DERIVATIVES AS GPR120 AGONISTS LG LIFE SCIENCES LTD. (KR) 2014-12-31 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 (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-20160168096-A1 BIARYL DERIVATIVES AS GPR120 AGONISTS GPR119, GLP1R, GIPR SCN9A 4618/4885GPBAR1 11/4885KCNH2 2593/4885
US-10221138-B2 Biaryl derivatives as GPR120 agonists GPR119, GLP1R, GIPR SCN9A 4618/4885GPBAR1 11/4885KCNH2 2593/4885

“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.