SCHEMBL3526360

SCHEMBL3526360

COC(=O)CCCC#Cc1cc(Cl)ccc1NS(=O)(=O)c1cccc(Cl)c1Cl

nearest known ligand 0.48

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PTGES2 Q9H7Z7 7/20 0.48
ACLY P53396 1/20 0.43
CCR4 P51679 8/20 0.41
MAPT P10636 1/20 0.39
SLC22A12 Q96S37 1/20 0.38
MAP3K20 Q9NYL2 1/20 0.38
SLC16A3 O15427 1/20 0.38
SLC16A7 O60669 1/20 0.38
SLC16A8 O95907 1/20 0.38
HTR5A P47898 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
SCHEMBL3526026 0.94 PTGES2 (0.50) PTGES2ACLYCCR4SLC22A12MAP3K20
SCHEMBL3523363 0.87 SLC16A3 (0.43) ACLYSLC22A12SLC16A3SLC16A7SLC16A8
SCHEMBL3528151 0.84 KMT2A (0.56) SLC16A3SLC16A7SLC16A8HTR5A
SCHEMBL3524588 0.83 CCKBR (0.51)
SCHEMBL3527759 0.82 SLC16A3 (0.48) MAPTSLC16A3
SCHEMBL3524537 0.82 ACLY (0.47) ACLYCCR4MAPTSLC16A3SLC16A7
SCHEMBL3525579 0.82 CCKBR (0.42) ACLYSLC22A12SLC16A3SLC16A7SLC16A8
SCHEMBL3520453 0.82 ERBB2 (0.47) ACLYMAPT
SCHEMBL3523112 0.82 CCR9 (0.42) ACLYMAPT
SCHEMBL3522744 0.81 ALDH1A1 (0.48) MAPT

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 PTGES2 626/4885ACLY 1409/4885CCR4 3862/4885
US-20100286137-A1 Method of Treating Conditions Involving PPAR-Receptors with Indole Compounds GPR119, PPARA, PPARG PTGES2 283/4885ACLY 981/4885CCR4 3444/4885

“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.