SCHEMBL17028581

SCHEMBL17028581

FC1(c2ccc(Br)s2)CC1

nearest known ligand 0.41

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
HPGD P15428 3/20 0.32
POLB P06746 1/20 0.32
GSK3B P49841 1/20 0.32
CES2 O00748 1/20 0.32
CES1 P23141 1/20 0.32
SLC6A2 P23975 1/20 0.32
SLC6A4 P31645 1/20 0.32
SLC6A3 Q01959 1/20 0.32
DAO P14920 1/20 0.31
ALDH1A1 P00352 1/20 0.30

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
SCHEMBL17028596 0.77 CES2 (0.37) HPGDPOLBGSK3BCES2CES1
SCHEMBL17028541 0.73 SLC6A2 (0.35) HPGDPOLBCES2CES1SLC6A2
SCHEMBL2876560 0.72 HPGD (0.37) HPGDPOLBGSK3BCES2CES1
SCHEMBL29268033 0.72 SLC6A2 (0.30) HPGDPOLBSLC6A2SLC6A4SLC6A3
SCHEMBL9085983 0.70 HTT (0.36) HPGDPOLBGSK3BCES2CES1
SCHEMBL29134942 0.68 HPGD (0.33) HPGDPOLBGSK3BCES2CES1
SCHEMBL17077985 0.64 ALDH1A1 (0.38) HPGDPOLBSLC6A2SLC6A4SLC6A3
SCHEMBL13209013 0.63 SLC6A2 (0.40) HPGDPOLBCES2CES1SLC6A2
SCHEMBL13678442 0.61 PDE2A (0.35)
SCHEMBL29512553 0.60 SLC6A2 (0.31) SLC6A2SLC6A4SLC6A3ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3107901-B1 COMPOUNDS FOR USE AS GPR120 AGONISTS PIRAMAL ENTPR LTD (IN) 2020-04-01 EP disclosed
US-10227360-B2 Compounds for use as GPR120 agonists Piramal Enterprises Limited (IN) 2019-03-12 US disclosed
EP-3107901-A1 COMPOUNDS FOR USE AS GPR120 AGONISTS Piramal Enterprises Limited (IN) 2016-12-28 EP disclosed
US-20160347768-A1 COMPOUNDS FOR USE AS GPR120 AGONISTS Piramal Enterprises Limited (IN) 2016-12-01 US disclosed
WO-2015125085-A1 COMPOUNDS FOR USE AS GPR120 AGONISTS Piramal Enterprises Limited (IN) 2015-08-27 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-10227360-B2 Compounds for use as GPR120 agonists GPR119, GPR55, GPR180 HPGD 718/4885POLB 3328/4885GSK3B 1376/4885
US-20160347768-A1 COMPOUNDS FOR USE AS GPR120 AGONISTS GPR119, GPR55, GPR180 HPGD 718/4885POLB 3328/4885GSK3B 1376/4885

“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.