SCHEMBL4833917

SCHEMBL4833917

O=C(O)c1ccc(OCCNC(=O)[C@@H]2Cc3ccccc3N2S(=O)(=O)c2ccc(-c3ccc(F)cc3)cc2)cc1F

nearest known ligand 0.43

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MMP8 P22894 8/20 0.43
MMP3 P08254 5/20 0.43
PTGER3 P43115 1/20 0.39
TRPA1 O75762 6/20 0.39
ALDH1A1 P00352 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
RORC P51449 1/20 0.39
MAPT P10636 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38

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
SCHEMBL4838206 0.93 CA12 (0.40) MMP8MMP3PTGER3TRPA1ALDH1A1
SCHEMBL4833504 0.92 MAPT (0.40) MMP8MMP3PTGER3TRPA1ALDH1A1
SCHEMBL4840897 0.91 MMP8 (0.37) MMP8MMP3PTGER3TRPA1ALDH1A1
SCHEMBL4833227 0.91 MMP1 (0.38) MMP8MMP3PTGER3TRPA1ALDH1A1
SCHEMBL4842969 0.91 MAPT (0.40) MMP8MMP3TRPA1ALDH1A1NPSR1
SCHEMBL4845607 0.90 RORC (0.42) MMP8MMP3TRPA1RORC
SCHEMBL4840536 0.89 MMP8 (0.45) MMP8MMP3PTGER3ALDH1A1NPSR1
SCHEMBL1043997 0.89 MMP8 (0.45) MMP8MMP3PTGER3ALDH1A1NPSR1
SCHEMBL4840519 0.88 MMP8 (0.44) MMP8MMP3PTGER3ALDH1A1NPSR1
SCHEMBL4833189 0.87 MMP8 (0.49) MMP8MMP3PTGER3TRPA1ALDH1A1

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 MMP8 3968/4885MMP3 3739/4885PTGER3 3044/4885

“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.