SCHEMBL4833567

SCHEMBL4833567

COc1ccc2c(c1)CC(C(=O)NCc1ccc(C(=O)O)cc1)N2S(=O)(=O)c1ccc(-c2ccc(F)cc2F)cc1

nearest known ligand 0.44

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
TRPA1 O75762 4/20 0.44
PKM P14618 1/20 0.42
GNRHR P30968 1/20 0.42
TAS2R14 Q9NYV8 2/20 0.41
MAPT P10636 2/20 0.41
KMT2A Q03164 2/20 0.41
SMN1; SMN2 Q16637 1/20 0.40
TP53 P04637 1/20 0.40
TSHR P16473 1/20 0.39

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
SCHEMBL4842258 0.90 CA12 (0.40) TRPA1GNRHRTAS2R14MAPTKMT2A
SCHEMBL4844332 0.88 MEN1 (0.40) TRPA1GNRHRMAPTKMT2A
SCHEMBL4843919 0.86 TRPA1 (0.41) TRPA1PKMGNRHR
SCHEMBL4833989 0.86 TRPA1 (0.42) TRPA1PKMMAPT
SCHEMBL4843213 0.84 MAPT (0.42) GNRHRTAS2R14MAPTSMN1; SMN2TSHR
SCHEMBL4833652 0.83 MAPT (0.43) PKMGNRHRMAPTTSHR
Hydrochloric Acid SCHEMBL4845617 0.83 MAPT (0.41) GNRHRMAPTSMN1; SMN2TSHR
SCHEMBL4841593 0.82 TRPA1 (0.40) TRPA1
SCHEMBL4840531 0.81 RORC (0.39) TRPA1GNRHRMAPTKMT2A
SCHEMBL4845609 0.81 MAPT (0.41) GNRHRMAPTSMN1; SMN2TSHR

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 368/4885PKM 1415/4885GNRHR 2528/4885

“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.