SCHEMBL4845155

SCHEMBL4845155

COC(=O)c1ccc(OCCNC(=O)[C@@H]2Cc3ccccc3N2S(=O)(=O)c2ccc(-c3ccc(F)cc3C)cc2)c(F)c1

nearest known ligand 0.36

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
TRPA1 O75762 4/20 0.36
MAPT P10636 1/20 0.36
POLB P06746 2/20 0.35
RORC P51449 1/20 0.35
MAPK1 P28482 1/20 0.35
HCAR2 Q8TDS4 1/20 0.35
MMP1 P03956 1/20 0.35
MMP9 P14780 1/20 0.35
MMP13 P45452 1/20 0.35
ADAM17 P78536 1/20 0.35
TSHR P16473 1/20 0.34
PTGS2 P35354 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
PTGER3 P43115 1/20 0.34
HTR6 P50406 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
SCHEMBL4841609 0.95 TRPA1 (0.36) TRPA1MAPTPOLBRORCMAPK1
SCHEMBL4842813 0.94 TRPA1 (0.37) TRPA1MAPTPOLBRORCMAPK1
SCHEMBL4841408 0.94 TRPA1 (0.36) TRPA1MAPTPOLBRORCMAPK1
SCHEMBL4840502 0.94 MAPT (0.39) TRPA1MAPTPOLBRORCMAPK1
SCHEMBL4842704 0.93 GNRHR (0.36) TRPA1MAPTPOLBRORCMAPK1
SCHEMBL4838081 0.92 MAPT (0.40) TRPA1MAPTPOLBRORCMAPK1
SCHEMBL4833128 0.92 TRPA1 (0.39) TRPA1MAPTRORC
SCHEMBL4832976 0.90 MAPT (0.39) TRPA1MAPTPOLBRORCMAPK1
SCHEMBL4838499 0.90 TRPA1 (0.37) TRPA1MAPTPOLBRORCMAPK1
SCHEMBL4833497 0.89 TSHR (0.37) TRPA1MAPTPOLBRORCMAPK1

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 368/4885MAPT 763/4885POLB 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.