SCHEMBL16334286

SCHEMBL16334286

CCOC(=O)CCCCSc1c(F)cc(B2OC(C)(C)C(C)(C)O2)cc1F

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGDR2 Q9Y5Y4 3/20 0.35
CYP1A2 P05177 1/20 0.35
ROCK1 Q13464 1/20 0.34
PPOX P50336 2/20 0.34
MAPT P10636 2/20 0.34
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
FFAR4 Q5NUL3 2/20 0.33
TNF P01375 1/20 0.33
CYP4F2 P78329 1/20 0.33
CYP4A11 Q02928 1/20 0.33
KDM4E B2RXH2 1/20 0.32
IDO1 P14902 1/20 0.32
ALDH1A1 P00352 1/20 0.32
CYP3A4 P08684 1/20 0.32
ALOX15 P16050 1/20 0.32
TSHR P16473 1/20 0.32
HSD17B10 Q99714 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
ABL1 P00519 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
SCHEMBL16334583 0.99 PTGDR2 (0.36) PTGDR2CYP1A2ROCK1PPOXMAPT
SCHEMBL16333888 0.97 PPOX (0.36) PTGDR2CYP1A2ROCK1PPOXMAPT
SCHEMBL19511093 0.84 CYP4F2 (0.40) CYP1A2ROCK1MAPTMEN1KMT2A
SCHEMBL16334131 0.83 ROCK1 (0.39) PTGDR2CYP1A2ROCK1PPOXMAPT
SCHEMBL16335123 0.82 PDK2 (0.39) CYP1A2ROCK1MAPTMEN1KMT2A
SCHEMBL16334945 0.81 FFAR1 (0.38) CYP1A2ROCK1MAPTMEN1KMT2A
SCHEMBL16334526 0.81 LIPG (0.39) PTGDR2MAPTCYP4F2CYP4A11ALDH1A1
SCHEMBL16334617 0.81 PDK2 (0.38) CYP1A2ROCK1MAPTFFAR4TNF
SCHEMBL19510749 0.80 TOP2A (0.41) CYP1A2ROCK1MAPTMEN1KMT2A
SCHEMBL22150429 0.79 LPL (0.43) ROCK1FFAR4

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 7 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
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 PTGDR2 233/4885CYP1A2 594/4885ROCK1 1111/4885
US-10221138-B2 Biaryl derivatives as GPR120 agonists GPR119, GLP1R, GIPR PTGDR2 233/4885CYP1A2 594/4885ROCK1 1111/4885

“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.