SCHEMBL1000635

SCHEMBL1000635

CC(C)Oc1ccc(C(=O)NCCc2cccc(S(=O)(=O)N3CCCCC3)c2)cc1

nearest known ligand 0.66

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.66
SMN1; SMN2 Q16637 2/20 0.66
MAPT P10636 1/20 0.66
TDP1 Q9NUW8 1/20 0.56
HSD17B10 Q99714 1/20 0.55
MEN1 O00255 2/20 0.55
KMT2A Q03164 2/20 0.55
GAA P10253 1/20 0.54
RAB9A P51151 1/20 0.53

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
SCHEMBL1001348 0.90 ALDH1A1 (0.66) ALDH1A1SMN1; SMN2MAPTMEN1KMT2A
SCHEMBL1001389 0.81 ALDH1A1 (0.60) ALDH1A1SMN1; SMN2MAPTHSD17B10MEN1
SCHEMBL1001196 0.79 MAPT (0.60) ALDH1A1MAPTTDP1MEN1KMT2A
SCHEMBL1002288 0.79 SMN1; SMN2 (0.77) ALDH1A1SMN1; SMN2MAPTHSD17B10
SCHEMBL1001582 0.78 KMT2A (0.80) ALDH1A1SMN1; SMN2MAPTTDP1MEN1
SCHEMBL1000610 0.73 HSD17B10 (0.72) ALDH1A1SMN1; SMN2MAPTHSD17B10KMT2A
SCHEMBL15276801 0.72 SMN1; SMN2 (0.76) ALDH1A1SMN1; SMN2MAPTHSD17B10MEN1
SCHEMBL18997900 0.72 MAPT (0.67) ALDH1A1SMN1; SMN2MAPTRAB9A
SCHEMBL16788114 0.71 HTT (0.69) ALDH1A1SMN1; SMN2MEN1KMT2AGAA
SCHEMBL15276800 0.71 SMN1; SMN2 (0.71) ALDH1A1SMN1; SMN2MAPTTDP1HSD17B10

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
CN-104352492-A Long-chain fatty acyl elongase inhibitor comprising arylsulfonyl derivative as active ingredient MSD KK 2015-02-18 CN disclosed
EP-2280001-B1 LONG-CHAIN FATTY ACID ELONGATION ENZYME INHIBITOR COMPRISING ARYLSULFONYL DERIVATIVE AS ACTIVE INGREDIENT MSD KK (JP) 2014-10-15 EP disclosed
US-8420823-B2 Long-chain fatty acyl elongase inhibitor comprising arylsulfonyl derivative as active ingredient MSD K.K. (JP) 2013-04-16 US disclosed
EP-2280001-A1 LONG-CHAIN FATTY ACID ELONGATION ENZYME INHIBITOR COMPRISING ARYLSULFONYL DERIVATIVE AS ACTIVE INGREDIENT Banyu Pharmaceutical Co., Ltd. (JP) 2011-02-02 EP disclosed
US-20110009622-A1 LONG-CHAIN FATTY ACYL ELONGASE INHIBITOR COMPRISING ARYLSULFONYL DERIVATIVE AS ACTIVE INGREDIENT MSD K.K. (JP) 2011-01-13 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 (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-20110009622-A1 LONG-CHAIN FATTY ACYL ELONGASE INHIBITOR COMPRISING ARYLSULFONYL DERIVATIVE AS ACTIVE INGREDIENT ELOVL1, ELOVL6, ELOVL3 ALDH1A1 188/4885SMN1; SMN2 965/4885MAPT 4157/4885

“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.