SCHEMBL4833211

SCHEMBL4833211

COc1cccc2c1CC(C(=O)O)N2S(=O)(=O)c1ccc(-c2ccc(F)cc2)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.47
GAA P10253 2/20 0.46
MMP3 P08254 2/20 0.43
MMP8 P22894 2/20 0.43
GFER P55789 2/20 0.40
KMT2A Q03164 2/20 0.40
FFAR2 O15552 1/20 0.40
MEN1 O00255 1/20 0.40
AADAT Q8N5Z0 1/20 0.40
MAPT P10636 1/20 0.39
CA12 O43570 1/20 0.39
CA1 P00915 1/20 0.39
CA2 P00918 1/20 0.39
CA9 Q16790 1/20 0.39
PTGS1 P23219 1/20 0.39
PTGS2 P35354 1/20 0.39
MCL1 Q07820 1/20 0.39
PKM P14618 1/20 0.39
HTR1A P08908 1/20 0.38
HTR7 P34969 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
SCHEMBL4843043 0.91 ALDH1A1 (0.47) ALDH1A1GAAMMP3MMP8GFER
SCHEMBL4837892 0.89 GHSR (0.41) ALDH1A1GAAGFERKMT2AFFAR2
Hydrochloric Acid SCHEMBL4833643 0.89 GHSR (0.41) ALDH1A1GAAGFERKMT2AFFAR2
SCHEMBL4832819 0.88 ALDH1A1 (0.41) ALDH1A1GAAGFERKMT2AFFAR2
SCHEMBL4842800 0.86 RORC (0.44) GAAMMP3MMP8KMT2AMAPT
SCHEMBL926520 0.85 MEN1 (0.43) ALDH1A1GAAGFERKMT2AMEN1
SCHEMBL4833640 0.81 GHSR (0.41) ALDH1A1GAAGFERKMT2AMEN1
SCHEMBL4841794 0.81 GHSR (0.42) ALDH1A1GAAGFERKMT2AMEN1
SCHEMBL4845158 0.80 MMP8 (0.58) MMP3MMP8KMT2AMEN1MCL1
SCHEMBL4842551 0.80 ALDH1A1 (0.41) ALDH1A1MMP3KMT2AMEN1MAPT

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 ALDH1A1 1819/4885GAA 1612/4885MMP3 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.