SCHEMBL387208

SCHEMBL387208

CS(=O)(=O)c1ccc(-c2ccc(OCc3ccccc3)c(F)c2)nc1

nearest known ligand 0.46

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
RORC P51449 1/20 0.46
ERN1 O75460 1/20 0.45
PTGS2 P35354 6/20 0.44
PTGER1 P34995 5/20 0.43
SCN9A Q15858 1/20 0.43
ALOX5AP P20292 2/20 0.42
FEN1 P39748 1/20 0.42
SLC6A9 P48067 1/20 0.41
PTGS1 P23219 2/20 0.41
IKBKB O14920 1/20 0.41

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
SCHEMBL387683 0.80 ERN1 (0.44) ERN1PTGER1ALOX5APFEN1
SCHEMBL8616633 0.80 MRGPRX4 (0.48) ERN1PTGER1ALOX5APFEN1
SCHEMBL3920789 0.77 LRRK2 (0.42) ERN1ALOX5APFEN1
SCHEMBL14533970 0.76 CA12 (0.57) ERN1PTGS2PTGER1PTGS1IKBKB
SCHEMBL8611382 0.75 ALOX5AP (0.47) ERN1PTGER1ALOX5APFEN1
SCHEMBL8613081 0.75 ALOX5AP (0.47) ERN1PTGER1ALOX5APFEN1
SCHEMBL388550 0.74 PTGS2 (0.50) PTGS2
SCHEMBL5715406 0.74 PTGER1 (0.52) PTGS2PTGER1
SCHEMBL13589551 0.72 RORC (0.53) RORCPTGS2PTGS1
SCHEMBL936289 0.72 SCN9A (0.50) ERN1PTGER1SCN9A

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
US-20120077812-A1 BICYCLIC COMPOUNDS AND USE AS ANTIDIABETICS FANG JING (US) 2012-03-29 US disclosed
US-8101634-B2 Bicyclic compounds and use as antidiabetics GLAXOSMITHKLINE LLC (US) 2012-01-24 US disclosed
EP-2325182-A1 Bicyclic compounds and use as antidiabetics Glaxosmithkline LLC (US) 2011-05-25 EP disclosed
US-20100029650-A1 BICYCLIC COMPOUNDS AND USE AS ANTIDIABETICS SMITH KLINE BEECHAM CORPORATION a corporation 2010-02-04 US disclosed
EP-2094683-A2 BICYCLIC COMPOUNDS AND USE AS ANTIDIABETICS SmithKline Beecham Corporation (US) 2009-09-02 EP disclosed
WO-2008070692-A2 BICYCLIC COMPOUNDS AND USE AS ANTIDIABETICS SMITHKLINE BEECHAM CORPORATION (US) 2008-06-12 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 (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-20120077812-A1 BICYCLIC COMPOUNDS AND USE AS ANTIDIABETICS GPR119, GOT2, PC RORC 902/4885ERN1 1649/4885PTGS2 1372/4885
US-20100029650-A1 BICYCLIC COMPOUNDS AND USE AS ANTIDIABETICS GPR119, GOT2, PC RORC 902/4885ERN1 1649/4885PTGS2 1372/4885

“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.