SCHEMBL5110197

SCHEMBL5110197

CC(=O)Nc1cc(C)cc(COc2c(Cl)cc(CC(F)C(=O)O)cc2Cl)c1

nearest known ligand 0.40

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
TACR1 P25103 2/20 0.40
FFAR1 O14842 2/20 0.39
KMT2A Q03164 3/20 0.36
MEN1 O00255 2/20 0.36
SLC7A5 Q01650 1/20 0.36
MAPK1 P28482 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
MRGPRX4 Q96LA9 1/20 0.35
RORC P51449 1/20 0.34
PTGER1 P34995 4/20 0.34
CLCN2 P51788 1/20 0.34
USP2 O75604 1/20 0.34
SENP5 Q96HI0 1/20 0.34
SENP2 Q9HC62 1/20 0.34
SENP1 Q9P0U3 1/20 0.34

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
SCHEMBL5112370 0.90 FFAR1 (0.39) FFAR1KMT2AMEN1MAPK1SMN1; SMN2
SCHEMBL5104161 0.89 KMT2A (0.39) TACR1FFAR1KMT2AMEN1SLC7A5
SCHEMBL5112161 0.89 ALDH1A1 (0.38) TACR1FFAR1KMT2AMEN1MAPK1
SCHEMBL5116750 0.89 THRB (0.42) TACR1FFAR1KMT2AMEN1SLC7A5
SCHEMBL4935426 0.89 FFAR1 (0.39) TACR1FFAR1KMT2AMEN1SLC7A5
SCHEMBL4931768 0.89 FFAR1 (0.40) TACR1FFAR1KMT2ASLC7A5MRGPRX4
SCHEMBL4931582 0.87 FFAR1 (0.39) TACR1FFAR1KMT2AMEN1SLC7A5
SCHEMBL5110521 0.86 MRGPRX4 (0.39) FFAR1MRGPRX4RORCPTGER1
SCHEMBL4932666 0.86 FFAR1 (0.38) TACR1FFAR1KMT2AMEN1SLC7A5
SCHEMBL5722645 0.86 FFAR1 (0.37) FFAR1KMT2AMEN1MAPK1SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080004251-A1 Novel Pharmaceutical Compositions Comprising Agonists of the Thyroid Receptor KARO BIO AB (SE) 2008-01-03 US 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-20080004251-A1 Novel Pharmaceutical Compositions Comprising Agonists of the Thyroid Receptor TSHR, TRHR, THRA TACR1 81/4885FFAR1 34/4885KMT2A 2895/4885

“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.