SCHEMBL4838429

SCHEMBL4838429

COC(=O)Cc1ccc(OCCNC(=O)[C@@H]2Cc3ccccc3N2S(=O)(=O)c2ccc(-c3cc(C(F)(F)F)ccc3Cl)cc2)c(Cl)c1

nearest known ligand 0.37

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PPARD Q03181 3/20 0.36
MRGPRX4 Q96LA9 2/20 0.36
MMP8 P22894 4/20 0.36
MMP3 P08254 2/20 0.36
FFAR4 Q5NUL3 1/20 0.35
RORC P51449 1/20 0.35
ALDH1A1 P00352 2/20 0.35
CYP3A4 P08684 1/20 0.35
CYP2C9 P11712 1/20 0.35
CYP2C19 P33261 1/20 0.35
RECQL P46063 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35
PPARG P37231 1/20 0.34
PPARA Q07869 1/20 0.34
HPGD P15428 1/20 0.34
KMT2A Q03164 1/20 0.34
TRPA1 O75762 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
SCHEMBL4844578 0.95 RORC (0.35) PPARDMMP8MMP3FFAR4RORC
SCHEMBL4845185 0.95 GAA (0.37) PPARDMMP8MMP3FFAR4ALDH1A1
SCHEMBL4845042 0.94 PPARD (0.41) PPARDMRGPRX4MMP8MMP3FFAR4
SCHEMBL4843247 0.92 FFAR4 (0.40) MMP8MMP3FFAR4RORCALDH1A1
SCHEMBL4837553 0.92 FFAR4 (0.40) MMP8MMP3FFAR4RORCALDH1A1
SCHEMBL4841488 0.92 ALDH1A1 (0.38) PPARDMRGPRX4MMP8MMP3RORC
SCHEMBL4833071 0.90 PTGDR2 (0.40) PPARDMMP8FFAR4ALDH1A1PPARG
SCHEMBL4838970 0.89 PPARD (0.39) PPARDMMP8MMP3FFAR4RORC
SCHEMBL4841527 0.88 MAPT (0.40) MMP8MMP3RORCALDH1A1TRPA1
SCHEMBL4840814 0.87 MAPT (0.38) MMP8MMP3RORCALDH1A1NPSR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7465811-B2 Indoline compounds LABORATOIRES FOURNIER S.A. (FR) 2008-12-16 US disclosed
US-20080119465-A1 Novel Indoline Compounds LABORATORIES FOURNIER S.A. (FR) 2008-05-22 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-20080119465-A1 Novel Indoline Compounds GPR119, INSR, IRS1 PPARD 258/4885MRGPRX4 675/4885MMP8 3968/4885

“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.