SCHEMBL4031469

SCHEMBL4031469

O=C(NCc1ccccc1)[C@@H]1Cc2ccccc2N1S(=O)(=O)c1ccc(-c2ccc(F)cc2)cc1

nearest known ligand 0.50

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MMP8 P22894 4/20 0.50
MMP3 P08254 3/20 0.50
RORC P51449 3/20 0.47
TSHR P16473 1/20 0.46
ALDH1A1 P00352 3/20 0.46
PKM P14618 1/20 0.46
FKBP1A P62942 1/20 0.46
ATM Q13315 1/20 0.46
LMNA P02545 1/20 0.45
TRPA1 O75762 3/20 0.45
POLB P06746 1/20 0.44

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
SCHEMBL4843338 0.89 LMNA (0.46) MMP8MMP3RORCALDH1A1PKM
SCHEMBL5250841 0.87 ALDH1A1 (0.53) MMP8MMP3ALDH1A1PKMFKBP1A
SCHEMBL4347387 0.86 MMP8 (0.48) MMP8MMP3RORCATMTRPA1
SCHEMBL4036169 0.86 MMP8 (0.48) MMP8MMP3RORCATM
SCHEMBL3827372 0.85 RORC (0.46) MMP8MMP3RORCTRPA1
SCHEMBL4844332 0.84 MEN1 (0.40) MMP8MMP3RORCFKBP1AATM
SCHEMBL1043993 0.84 TRPA1 (0.40) MMP8MMP3RORCFKBP1AATM
SCHEMBL926836 0.84 FKBP1A (0.48) RORCALDH1A1PKMFKBP1ALMNA
SCHEMBL4845158 0.84 MMP8 (0.58) MMP8MMP3LMNAPOLB
SCHEMBL926215 0.84 PSEN1 (0.51) MMP8MMP3ALDH1A1FKBP1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1885695-B1 INDOLINE COMPOUNDS FOURNIER LAB SA (FR) 2009-02-25 EP disclosed
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 3739/4885RORC 1777/4885

“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.