SCHEMBL4842704

SCHEMBL4842704

COC(=O)c1ccc(OCCNC(=O)[C@@H]2Cc3ccccc3N2S(=O)(=O)c2ccc(-c3ccc(F)cc3Cl)cc2)c(F)c1

nearest known ligand 0.36

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
GNRHR P30968 1/20 0.36
TRPA1 O75762 4/20 0.36
POLB P06746 2/20 0.36
LMNA P02545 2/20 0.36
ALDH1A1 P00352 1/20 0.36
MAPT P10636 2/20 0.35
RORC P51449 1/20 0.35
MAPK1 P28482 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
PTGS2 P35354 1/20 0.34
SMN1; SMN2 Q16637 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
SCHEMBL4833497 0.94 TSHR (0.37) GNRHRTRPA1POLBLMNAALDH1A1
SCHEMBL4842813 0.94 TRPA1 (0.37) TRPA1POLBMAPTRORCMAPK1
SCHEMBL4840502 0.93 MAPT (0.39) TRPA1POLBLMNAMAPTRORC
SCHEMBL4841785 0.93 MAPT (0.36) GNRHRTRPA1POLBMAPTRORC
SCHEMBL4845155 0.93 TRPA1 (0.36) TRPA1POLBMAPTRORCMAPK1
SCHEMBL4839294 0.92 TRPA1 (0.38) GNRHRTRPA1RORCPSEN1PSEN2
SCHEMBL4838081 0.92 MAPT (0.40) TRPA1POLBMAPTRORCMAPK1
SCHEMBL4837709 0.90 RORC (0.38) GNRHRTRPA1POLBLMNAALDH1A1
SCHEMBL4842956 0.89 MAPT (0.39) GNRHRTRPA1POLBLMNAALDH1A1
SCHEMBL4839596 0.88 POLB (0.36) GNRHRTRPA1POLBLMNAALDH1A1

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 GNRHR 2528/4885TRPA1 368/4885POLB 4775/4885

“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.