SCHEMBL3095367

SCHEMBL3095367

Cc1oc(-c2ccc(C(F)(F)F)cc2)cc1C(Nc1ccc(C(=O)O)cc1)C1CCCCC1

nearest known ligand 0.43

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
RCE1 Q9Y256 1/20 0.43
TRPV1 Q8NER1 1/20 0.40
P2RY14 Q15391 1/20 0.38
EPHX2 P34913 2/20 0.38
GLP1R P43220 1/20 0.37
GCGR P47871 1/20 0.37
GIPR P48546 1/20 0.37
GCG P01275 4/20 0.37
ADRB1 P08588 1/20 0.37
ADRB3 P13945 1/20 0.37
DGAT1 O75907 1/20 0.37
MMP13 P45452 1/20 0.37
MCHR1 Q99705 2/20 0.37
CYP3A4 P08684 1/20 0.37
LTA4H P09960 1/20 0.36
PLAU P00749 1/20 0.36
HPN P05981 1/20 0.36

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
SCHEMBL3113651 0.90 RCE1 (0.45) RCE1MMP13CYP3A4
SCHEMBL3094894 0.88 RCE1 (0.49) RCE1MMP13CYP3A4
SCHEMBL3102234 0.88 GCGR (0.42) RCE1TRPV1EPHX2GCGRGIPR
SCHEMBL3102108 0.88 RCE1 (0.41) RCE1TRPV1P2RY14EPHX2GLP1R
SCHEMBL3107093 0.88 GCGR (0.53) GLP1RGCGRGIPRGCG
SCHEMBL3107553 0.88 RCE1 (0.49) RCE1MMP13CYP3A4LTA4H
SCHEMBL3095487 0.88 RCE1 (0.45) RCE1MMP13CYP3A4
SCHEMBL3101341 0.87 RCE1 (0.48) RCE1DGAT1CYP3A4
SCHEMBL3107042 0.87 TRPV1 (0.40) RCE1TRPV1P2RY14EPHX2GLP1R
SCHEMBL3110245 0.87 RCE1 (0.44) RCE1TRPV1GLP1RGCGRGIPR

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 RCE1 3126/4885TRPV1 2757/4885P2RY14 2395/4885

“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.