SCHEMBL3524537

SCHEMBL3524537

COC(=O)CCC#Cc1cc(Cl)ccc1NS(=O)(=O)c1ccc(Cl)cc1Cl

nearest known ligand 0.47

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ACLY P53396 1/20 0.47
PTGDR2 Q9Y5Y4 9/20 0.42
HPGD P15428 1/20 0.41
TSHR P16473 1/20 0.41
MCL1 Q07820 1/20 0.41
SLC40A1 Q9NP59 4/20 0.41
SLC16A3 O15427 1/20 0.41
SLC16A7 O60669 1/20 0.41
SLC16A8 O95907 1/20 0.41
HTR5A P47898 1/20 0.41
MAPT P10636 1/20 0.40
ITGA1 P56199 2/20 0.40
PTGDR Q13258 7/20 0.40
CCR4 P51679 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
SCHEMBL3526026 0.88 PTGES2 (0.50) ACLYCCR4
SCHEMBL3525803 0.87 ALDH1A1 (0.48) MAPT
SCHEMBL3524342 0.85 SLC16A3 (0.42) ACLYTSHRSLC16A3SLC16A7SLC16A8
SCHEMBL3523698 0.85 ERBB2 (0.50) ACLYPTGDR2MAPT
SCHEMBL3529261 0.84 CCR9 (0.43) ACLYMAPT
SCHEMBL3527669 0.84 LMNA (0.48) MAPT
SCHEMBL3519735 0.84 SLC16A3 (0.45) ACLYTSHRMCL1SLC16A3SLC16A7
SCHEMBL3524449 0.84 ALDH1A1 (0.53) HPGDTSHRMAPT
SCHEMBL3524514 0.84 HSD17B2 (0.53)
SCHEMBL3525865 0.84 CCR2 (0.48) ACLYPTGDR2MAPT

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 ACLY 1409/4885PTGDR2 1921/4885HPGD 497/4885
US-20100286137-A1 Method of Treating Conditions Involving PPAR-Receptors with Indole Compounds GPR119, PPARA, PPARG ACLY 981/4885PTGDR2 383/4885HPGD 449/4885

“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.