SCHEMBL3098476

SCHEMBL3098476

CCc1oc(-c2ccc(C(F)(F)F)cc2)cc1C(Oc1ccc(C(=O)O)cc1)c1ccccc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SRD5A2 P31213 1/20 0.44
PPARD Q03181 1/20 0.43
SLC6A9 P48067 7/20 0.40
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
ALDH1A1 P00352 1/20 0.39
PKM P14618 1/20 0.39
HTT P42858 1/20 0.39
HSD17B10 Q99714 1/20 0.39
PPARG P37231 1/20 0.38
PPARA Q07869 1/20 0.38
PTPN1 P18031 2/20 0.38
FFAR1 O14842 1/20 0.37
NR4A2 P43354 1/20 0.37
SLC6A4 P31645 1/20 0.37
HRH3 Q9Y5N1 1/20 0.37
MRGPRX4 Q96LA9 1/20 0.37
KDM4E B2RXH2 1/20 0.37
NPC1 O15118 1/20 0.37
TP53 P04637 1/20 0.37

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
SCHEMBL3113372 0.88 GCG (0.47)
SCHEMBL3101633 0.86 SLC6A9 (0.42) PPARDSLC6A9MEN1KMT2AFFAR1
SCHEMBL3101970 0.86 PPARD (0.46) SRD5A2PPARDMEN1KMT2AALDH1A1
SCHEMBL3102399 0.83 PPARD (0.43) SRD5A2PPARDSLC6A9MEN1KMT2A
SCHEMBL3099931 0.80 PPARD (0.41) PPARDPPARGPPARANPC1RAB9A
SCHEMBL3100237 0.77 CYP1A1 (0.40) FFAR1CYP1A2CYP3A4CYP2D6CYP2C9
SCHEMBL3107388 0.76 PPARD (0.58) SRD5A2PPARDPPARGPPARAFFAR1
SCHEMBL3104337 0.75 GCGR (0.46)
SCHEMBL3101589 0.73 GCGR (0.41) PPARDSLC6A9MEN1KMT2AALDH1A1
SCHEMBL3101211 0.73 PPARD (0.45) SRD5A2PPARDSLC6A9KMT2APPARG

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2210876-B1 HETEROCYCLIC COMPOUND AS GLUCAGON ANTAGONIST TAKEDA PHARMACEUTICAL (JP) 2015-05-20 EP disclosed
US-8309580-B2 Heterocyclic compound TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2012-11-13 US disclosed
US-20100256156-A1 HETEROCYCLIC COMPOUND TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2010-10-07 US disclosed
EP-2210876-A1 HETEROCYCLIC COMPOUND Takeda Pharmaceutical Company Limited (JP) 2010-07-28 EP 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-20100256156-A1 HETEROCYCLIC COMPOUND GLP1R, GPR119, GCGR SRD5A2 607/4885PPARD 1129/4885SLC6A9 1729/4885

“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.