SCHEMBL3368425

SCHEMBL3368425

CN(C)CCCCCCOc1ccc(N(C)S(=O)(=O)c2ccc(F)cc2)cc1

nearest known ligand 0.62

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.60
SMN1; SMN2 Q16637 2/20 0.60
CACNA1B Q00975 4/20 0.58
CACNA1H O95180 3/20 0.58
FFAR1 O14842 1/20 0.57
L3MBTL1 Q9Y468 1/20 0.53
NPSR1 Q6W5P4 1/20 0.53
MAPT P10636 3/20 0.50
TDP1 Q9NUW8 1/20 0.50
ALDH1A1 P00352 3/20 0.48
MEN1 O00255 1/20 0.48
KMT2A Q03164 1/20 0.48
RAB9A P51151 1/20 0.46
CASP6 P55212 1/20 0.46

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
SCHEMBL3362825 0.89 FFAR1 (0.54) KDM4ESMN1; SMN2CACNA1BCACNA1HFFAR1
SCHEMBL3365676 0.89 FFAR1 (0.54) KDM4ESMN1; SMN2CACNA1BCACNA1HFFAR1
SCHEMBL3368579 0.89 FFAR1 (0.54) KDM4ESMN1; SMN2CACNA1BCACNA1HFFAR1
SCHEMBL3367350 0.88 FFAR1 (0.53) KDM4ESMN1; SMN2CACNA1BCACNA1HFFAR1
SCHEMBL3368340 0.88 FFAR1 (0.53) KDM4ESMN1; SMN2CACNA1BCACNA1HFFAR1
SCHEMBL3363565 0.88 PGR (0.57) KDM4ESMN1; SMN2L3MBTL1MAPTALDH1A1
SCHEMBL3365132 0.88 L3MBTL1 (0.53) KDM4ESMN1; SMN2CACNA1BCACNA1HL3MBTL1
SCHEMBL3368253 0.88 FFAR1 (0.57) KDM4ESMN1; SMN2CACNA1BCACNA1HFFAR1
SCHEMBL3364934 0.87 FFAR1 (0.52) KDM4ESMN1; SMN2CACNA1BCACNA1HFFAR1
SCHEMBL3366148 0.87 FFAR1 (0.52) KDM4ESMN1; SMN2CACNA1BCACNA1HFFAR1

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1303503-B1 ANILINE DERIVATIVES HOFFMANN LA ROCHE (CH) 2010-01-27 EP disclosed
US-6683201-B2 FOR THERAPY AND PROPHYLAXIS OF HYPERCHOLESTEROLEMIA, HYPERLIPEMIA, ARTERIOSCLEROSIS, VASCULAR DISEASES, MYCOSES, PARASITE INFECTIONS, GALLSTONES, TUMORS AND/OR HYPERPROLIFERATIVE DISORDERS, DIABETES HOFFMANN-LA ROCHE INC. 2004-01-27 US disclosed
EP-1303503-A2 ANILINE DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2003-04-23 EP disclosed
US-20020038025-A1 Analine derivatives as OSC inhibitors F.HOFFMANN-LA ROCHE AG (CH) 2002-03-28 US disclosed
WO-2002006189-A2 ANILINE DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2002-01-24 WO 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 (1 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-20020038025-A1 Analine derivatives as OSC inhibitors LSS, CYP51A1, CYP46A1 KDM4E 3964/4885SMN1; SMN2 4520/4885CACNA1B 2736/4885

“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.