SCHEMBL3525286

SCHEMBL3525286

COC(=O)CCC#Cc1cc(Cl)ccc1NS(=O)(=O)c1ccc(C#N)cc1

nearest known ligand 0.43

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CCR2 P41597 2/20 0.43
CCR9 P51686 2/20 0.43
MAPK1 P28482 2/20 0.41
ACLY P53396 1/20 0.41
ALDH1A1 P00352 2/20 0.41
EEF2K O00418 1/20 0.41
LMNA P02545 2/20 0.41
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
TP53 P04637 1/20 0.41
GAA P10253 1/20 0.41
MAPT P10636 1/20 0.41
HTT P42858 1/20 0.41
HSD17B10 Q99714 1/20 0.41
STAT3 P40763 1/20 0.39
KDM1A O60341 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
SCHEMBL3525803 0.92 ALDH1A1 (0.48) CCR2CCR9MAPK1ALDH1A1LMNA
SCHEMBL3527669 0.89 LMNA (0.48) CCR2CCR9ALDH1A1LMNAKMT2A
SCHEMBL3526879 0.88 LMNA (0.49) CCR2CCR9ALDH1A1LMNAKMT2A
SCHEMBL3527490 0.88 LMNA (0.53) CCR9MAPK1ALDH1A1LMNAMEN1
SCHEMBL3523698 0.88 ERBB2 (0.50) CCR2CCR9ACLYALDH1A1LMNA
SCHEMBL3525551 0.87 CCR9 (0.48) CCR2CCR9MAPK1ALDH1A1LMNA
SCHEMBL3524039 0.87 CCR9 (0.49) CCR2CCR9MAPK1ALDH1A1LMNA
SCHEMBL3523501 0.87 CCR2 (0.47) CCR2CCR9MAPK1ACLYALDH1A1
SCHEMBL3524514 0.86 HSD17B2 (0.53) CCR2CCR9
SCHEMBL3521448 0.86 ACLY (0.50) CCR9ACLYALDH1A1LMNAHTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8436040-B2 Method of treating conditions involving PPAR-receptors with indole compounds LABORATOIRES FOURNIER S.A. (FR) 2013-05-07 US disclosed
US-20100286137-A1 Method of Treating Conditions Involving PPAR-Receptors with Indole Compounds LABORATORIES FOURNIER S.A. (FR) 2010-11-11 US disclosed
US-7795297-B2 Indole compounds, method of preparing them and uses thereof LABORATORIES FOURNIER S.A. (FR) 2010-09-14 US disclosed
US-20080153816-A1 Indole Compounds, Method of Preparing Them and Uses Thereof LABORATOIRES FOURNIER S.A. (FR) 2008-06-26 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 (2 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-20080153816-A1 Indole Compounds, Method of Preparing Them and Uses Thereof LIPG, GPR119, IAPP CCR2 1853/4885CCR9 2577/4885MAPK1 1726/4885
US-20100286137-A1 Method of Treating Conditions Involving PPAR-Receptors with Indole Compounds GPR119, PPARA, PPARG CCR2 875/4885CCR9 2408/4885MAPK1 2343/4885

“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.