SCHEMBL1001348

SCHEMBL1001348

CC(C)Oc1ccc(C(=O)NCc2cccc(S(=O)(=O)N3CCCCC3)c2)cc1

nearest known ligand 0.66

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.66
GAA P10253 1/20 0.66
RAB9A P51151 1/20 0.60
LMNA P02545 2/20 0.57
SMN1; SMN2 Q16637 2/20 0.55
KMT2A Q03164 2/20 0.55
MAPT P10636 1/20 0.55
NPC1 O15118 1/20 0.55
APOBEC3A P31941 1/20 0.55
APOBEC3G Q9HC16 1/20 0.55
HTT P42858 1/20 0.55
NPSR1 Q6W5P4 1/20 0.55
CNR1 P21554 1/20 0.55
CNR2 P34972 1/20 0.55
MEN1 O00255 1/20 0.54

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
SCHEMBL1000635 0.90 ALDH1A1 (0.66) ALDH1A1GAARAB9ASMN1; SMN2KMT2A
SCHEMBL1001196 0.80 MAPT (0.60) ALDH1A1LMNAKMT2AMAPTHTT
SCHEMBL1001582 0.80 KMT2A (0.80) ALDH1A1GAARAB9ALMNASMN1; SMN2
SCHEMBL1001389 0.79 ALDH1A1 (0.60) ALDH1A1GAARAB9ALMNASMN1; SMN2
SCHEMBL19916764 0.78 MAPK1 (0.79) ALDH1A1GAARAB9ALMNASMN1; SMN2
SCHEMBL1003299 0.78 MAPK1 (0.79) ALDH1A1GAARAB9ALMNASMN1; SMN2
SCHEMBL15276798 0.76 LMNA (0.71) ALDH1A1RAB9ALMNASMN1; SMN2KMT2A
SCHEMBL15952771 0.76 LMNA (0.71) ALDH1A1RAB9ALMNASMN1; SMN2KMT2A
SCHEMBL15952845 0.76 LMNA (0.71) ALDH1A1RAB9ALMNASMN1; SMN2KMT2A
SCHEMBL15276801 0.73 SMN1; SMN2 (0.76) ALDH1A1RAB9ALMNASMN1; SMN2KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2280001-B1 LONG-CHAIN FATTY ACID ELONGATION ENZYME INHIBITOR COMPRISING ARYLSULFONYL DERIVATIVE AS ACTIVE INGREDIENT MSD KK (JP) 2014-10-15 EP claimed
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 188/4885GAA 607/4885RAB9A 3688/4885

“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.