SCHEMBL4842969

SCHEMBL4842969

COc1cc(F)ccc1-c1ccc(S(=O)(=O)N2c3ccccc3C[C@H]2C(=O)NCCOc2ccc(C(=O)O)c(F)c2)cc1

nearest known ligand 0.40

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.40
TRPA1 O75762 5/20 0.39
MMP1 P03956 1/20 0.37
MMP9 P14780 1/20 0.37
MMP13 P45452 1/20 0.37
ADAM17 P78536 1/20 0.37
MMP8 P22894 5/20 0.37
MMP3 P08254 3/20 0.37
CA12 O43570 1/20 0.37
CA1 P00915 1/20 0.37
CA2 P00918 1/20 0.37
CA4 P22748 1/20 0.37
CA9 Q16790 1/20 0.37
ALDH1A1 P00352 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
LMNA P02545 1/20 0.36
FAAH O00519 1/20 0.36
DRD3 P35462 1/20 0.36

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
SCHEMBL4845004 0.94 MAPT (0.40) MAPTTRPA1MMP1MMP9MMP13
SCHEMBL4838206 0.93 CA12 (0.40) TRPA1MMP8MMP3CA12CA1
SCHEMBL4833227 0.92 MMP1 (0.38) MAPTTRPA1MMP1MMP9MMP13
SCHEMBL4840897 0.91 MMP8 (0.37) MAPTTRPA1MMP8MMP3CA12
SCHEMBL4844870 0.91 MAPT (0.42) MAPTTRPA1MMP1MMP9MMP13
SCHEMBL4833917 0.91 MMP8 (0.43) MAPTTRPA1MMP8MMP3ALDH1A1
SCHEMBL4845303 0.90 MAPT (0.42) MAPTTRPA1MMP1MMP9MMP13
SCHEMBL4841297 0.89 MAPT (0.41) MAPTTRPA1MMP1MMP9MMP13
SCHEMBL4838047 0.89 CA12 (0.39) MAPTTRPA1MMP1MMP9MMP13
SCHEMBL4832791 0.88 MAPT (0.42) MAPTTRPA1MMP1MMP9MMP13

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 MAPT 763/4885TRPA1 368/4885MMP1 3209/4885

“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.