SCHEMBL4842862

SCHEMBL4842862

O=C(O)c1ccc(OCCNC(=O)[C@@H]2Cc3ccccc3N2S(=O)(=O)c2ccc(-c3ccc(F)cc3Cl)cc2)nc1

nearest known ligand 0.38

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
TRPA1 O75762 17/20 0.38
RORC P51449 1/20 0.36
MAPT P10636 1/20 0.34
PSEN1 P49768 1/20 0.34
PSEN2 P49810 1/20 0.34
APH1B Q8WW43 1/20 0.34
NCSTN Q92542 1/20 0.34
APH1A Q96BI3 1/20 0.34
PSENEN Q9NZ42 1/20 0.34

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
SCHEMBL4837709 0.93 RORC (0.38) TRPA1RORC
SCHEMBL4842689 0.90 MMP8 (0.39) TRPA1MAPTPSEN1PSEN2APH1B
SCHEMBL4841785 0.90 MAPT (0.36) TRPA1RORCMAPTPSEN1PSEN2
SCHEMBL4837482 0.88 TSHR (0.35) TRPA1RORCMAPTPSEN1PSEN2
SCHEMBL4842895 0.87 TRPA1 (0.39) TRPA1RORC
SCHEMBL4839545 0.87 TRPA1 (0.36) TRPA1RORCMAPTPSEN1PSEN2
SCHEMBL4843193 0.85 PTGER3 (0.40) TRPA1RORCMAPTPSEN1PSEN2
SCHEMBL4842704 0.84 GNRHR (0.36) TRPA1RORCMAPTPSEN1PSEN2
SCHEMBL4840897 0.84 MMP8 (0.37) TRPA1MAPTPSEN1PSEN2APH1B
SCHEMBL4833497 0.84 TSHR (0.37) TRPA1RORCMAPTPSEN1PSEN2

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 TRPA1 368/4885RORC 1777/4885MAPT 763/4885

“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.