SCHEMBL3529397

SCHEMBL3529397

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

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.49
CCR9 P51686 3/20 0.48
TP53 P04637 2/20 0.45
MAPT P10636 2/20 0.45
FLT1 P17948 1/20 0.42
FLT4 P35916 1/20 0.42
KDR P35968 1/20 0.42
SLC16A3 O15427 1/20 0.42
FFAR4 Q5NUL3 2/20 0.42
MEN1 O00255 1/20 0.41
ALDH1A1 P00352 1/20 0.41
GAA P10253 1/20 0.41
HTT P42858 1/20 0.41
KMT2A Q03164 1/20 0.41
HSD17B10 Q99714 1/20 0.41
KEAP1 Q14145 2/20 0.41
SQSTM1 Q13501 1/20 0.41
NFE2L2 Q16236 1/20 0.41
EGFR P00533 1/20 0.41
ERBB2 P04626 1/20 0.41

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
SCHEMBL3525458 0.90 CCR2 (0.44) LMNACCR9MAPTALDH1A1MAPK1
SCHEMBL3523974 0.88 ALDH1A1 (0.48) LMNATP53MAPTSLC16A3MEN1
SCHEMBL3529238 0.88 ACLY (0.41) LMNACCR9TP53MAPTSLC16A3
SCHEMBL3524492 0.84 ALDH1A1 (0.43) LMNAMAPTMEN1ALDH1A1HTT
SCHEMBL3525988 0.84 TSHR (0.49) LMNAMAPTALDH1A1GAAHTT
SCHEMBL3523854 0.82 ALDH1A1 (0.43) LMNACCR9TP53MAPTSLC16A3
SCHEMBL3529380 0.82 PKM (0.48) LMNACCR9TP53MAPTSLC16A3
SCHEMBL3527218 0.81 ALDH1A1 (0.43) LMNACCR9MAPTSLC16A3MEN1
SCHEMBL3528038 0.81 LMNA (0.46) LMNATP53MAPTMEN1ALDH1A1
SCHEMBL3527490 0.81 LMNA (0.53) LMNACCR9TP53MAPTFLT1

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 LMNA 849/4885CCR9 2577/4885TP53 3755/4885
US-20100286137-A1 Method of Treating Conditions Involving PPAR-Receptors with Indole Compounds GPR119, PPARA, PPARG LMNA 1980/4885CCR9 2408/4885TP53 2497/4885

“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.