SCHEMBL3107388

SCHEMBL3107388

CCc1oc(-c2ccc(C(F)(F)F)cc2)cc1COc1ccc(C(=O)O)cc1

nearest known ligand 0.58

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PPARD Q03181 6/20 0.58
SRD5A2 P31213 1/20 0.53
NR4A2 P43354 2/20 0.48
MRGPRX4 Q96LA9 1/20 0.48
RXRA P19793 3/20 0.46
NR1H2 P55055 1/20 0.46
NR1H3 Q13133 1/20 0.46
MAOB P27338 2/20 0.46
PPARG P37231 3/20 0.45
PTGER4 P35408 3/20 0.45
PPARA Q07869 3/20 0.44
RXRB P28702 2/20 0.44
FFAR1 O14842 2/20 0.42
FFAR4 Q5NUL3 1/20 0.42

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
SCHEMBL3104908 0.90 PPARD (0.46) PPARDSRD5A2MRGPRX4RXRANR1H2
SCHEMBL3106760 0.86 SPHK2 (0.46) PPARDPPARGPPARAFFAR1FFAR4
SCHEMBL3101002 0.85 PPARD (0.43) PPARDSRD5A2RXRANR1H2NR1H3
SCHEMBL3906291 0.81 PPARD (0.59) PPARDPPARGPPARAFFAR1FFAR4
SCHEMBL3101970 0.79 PPARD (0.46) PPARDSRD5A2NR4A2MRGPRX4RXRA
SCHEMBL3101111 0.79 PPARD (0.48) PPARDSRD5A2NR4A2MRGPRX4RXRA
SCHEMBL3102399 0.78 PPARD (0.43) PPARDSRD5A2NR4A2RXRAPPARG
SCHEMBL3101927 0.78 GCGR (0.49) PTGER4
SCHEMBL3907312 0.78 PPARA (0.43) PPARDRXRANR1H2NR1H3PPARG
SCHEMBL13791244 0.77 PPARA (0.48) PPARDRXRANR1H2NR1H3PPARG

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 PPARD 1129/4885SRD5A2 607/4885NR4A2 421/4885

“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.