SCHEMBL3526683

SCHEMBL3526683

COC(=O)CCC#Cc1cc(C(F)(F)F)ccc1NS(=O)(=O)c1ccc(S(=O)(=O)N2CCOCC2)cc1

nearest known ligand 0.46

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 2/20 0.46
ALDH1A1 P00352 8/20 0.46
GAA P10253 2/20 0.46
LMNA P02545 4/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
MAPT P10636 1/20 0.44
KMT2A Q03164 2/20 0.42
HPGD P15428 1/20 0.42
PKM P14618 1/20 0.41
GLA P06280 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
SCHEMBL3528240 0.83 ALDH1A1 (0.46) ALDH1A1GAALMNAMAPTKMT2A
SCHEMBL3526988 0.80 HDAC3 (0.42) ALDH1A1LMNASMN1; SMN2MAPTPKM
SCHEMBL3526734 0.80 CCR9 (0.49) ALDH1A1
SCHEMBL3520054 0.78 LMNA (0.57) ALDH1A1GAALMNASMN1; SMN2MAPT
SCHEMBL3524774 0.76 ALDH1A1 (0.41) ALDH1A1LMNASMN1; SMN2MAPT
SCHEMBL3529176 0.76 MAPT (0.43) ALDH1A1LMNASMN1; SMN2MAPTKMT2A
SCHEMBL3525917 0.76 HDAC3 (0.41) ALDH1A1LMNASMN1; SMN2MAPTPKM
SCHEMBL3525396 0.75 ALDH1A1 (0.44) ALDH1A1GAAKMT2APKM
SCHEMBL3520224 0.75 TRPV1 (0.45) ALDH1A1LMNASMN1; SMN2MAPTPKM
SCHEMBL3522354 0.75 LMNA (0.46) ALDH1A1LMNASMN1; SMN2MAPTKMT2A

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 EPHX2 1151/4885ALDH1A1 1607/4885GAA 772/4885
US-20100286137-A1 Method of Treating Conditions Involving PPAR-Receptors with Indole Compounds GPR119, PPARA, PPARG EPHX2 2086/4885ALDH1A1 1453/4885GAA 1440/4885

“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.