SCHEMBL3527145

SCHEMBL3527145

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

nearest known ligand 0.45

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CCR2 P41597 2/20 0.45
CCR9 P51686 2/20 0.43
MAPK1 P28482 1/20 0.39
ALDH1A1 P00352 4/20 0.39
LMNA P02545 2/20 0.38
MAPT P10636 2/20 0.38
NPSR1 Q6W5P4 1/20 0.38
MEN1 O00255 1/20 0.38
TP53 P04637 1/20 0.38
GAA P10253 1/20 0.38
HTT P42858 1/20 0.38
KMT2A Q03164 1/20 0.38
HSD17B10 Q99714 1/20 0.38
METAP2 P50579 1/20 0.38

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
SCHEMBL3523501 0.94 CCR2 (0.47) CCR2CCR9MAPK1ALDH1A1LMNA
SCHEMBL3525068 0.89 LMNA (0.51) CCR9MAPK1ALDH1A1LMNAMAPT
SCHEMBL3525803 0.87 ALDH1A1 (0.48) CCR2CCR9MAPK1ALDH1A1LMNA
SCHEMBL3528825 0.87 ALDH1A1 (0.56) CCR2CCR9ALDH1A1MEN1KMT2A
SCHEMBL3520453 0.86 ERBB2 (0.47) CCR2CCR9ALDH1A1LMNAMAPT
SCHEMBL3523112 0.86 CCR9 (0.42) CCR2CCR9LMNAMAPTTP53
SCHEMBL3527669 0.84 LMNA (0.48) CCR2CCR9ALDH1A1LMNAMAPT
SCHEMBL3527490 0.83 LMNA (0.53) CCR9MAPK1ALDH1A1LMNAMAPT
SCHEMBL3526879 0.83 LMNA (0.49) CCR2CCR9ALDH1A1LMNAMAPT
SCHEMBL3527759 0.83 SLC16A3 (0.48) CCR9ALDH1A1LMNAMAPTNPSR1

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.