SCHEMBL4836741

SCHEMBL4836741

COC(=O)Cc1ccc(OCCNC(=O)[C@@H]2Cc3ccccc3N2S(=O)(=O)c2ccc(-c3cc(C(F)(F)F)ccc3F)cc2)cc1

nearest known ligand 0.40

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
FFAR4 Q5NUL3 1/20 0.40
MMP8 P22894 8/20 0.38
MMP3 P08254 4/20 0.38
RORC P51449 4/20 0.37
TRPA1 O75762 3/20 0.37
TSHR P16473 1/20 0.37
ALDH1A1 P00352 1/20 0.37
NPSR1 Q6W5P4 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
SCHEMBL4841330 0.93 MMP8 (0.38) MMP8MMP3RORCTRPA1ALDH1A1
SCHEMBL4845014 0.93 FFAR4 (0.42) FFAR4MMP8MMP3RORCTRPA1
SCHEMBL4843247 0.93 FFAR4 (0.40) FFAR4MMP8MMP3RORCTSHR
SCHEMBL4840814 0.93 MAPT (0.38) MMP8MMP3RORCTRPA1TSHR
SCHEMBL4837553 0.93 FFAR4 (0.40) FFAR4MMP8MMP3RORCTSHR
SCHEMBL4833217 0.91 POLB (0.39) MMP8MMP3TRPA1TSHRALDH1A1
SCHEMBL4841819 0.90 RORC (0.41) MMP8MMP3RORCALDH1A1NPSR1
SCHEMBL4837840 0.88 RORC (0.39) MMP8MMP3RORCALDH1A1NPSR1
SCHEMBL4841644 0.88 MMP8 (0.41) MMP8MMP3RORCTRPA1ALDH1A1
SCHEMBL4843240 0.88 MMP8 (0.42) MMP8MMP3TRPA1TSHRALDH1A1

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 FFAR4 125/4885MMP8 3968/4885MMP3 3739/4885

“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.