SCHEMBL1001981

SCHEMBL1001981

CC(C)Oc1ccc(NC(=O)c2cccc(S(=O)(=O)Cl)c2)cc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.54
MEN1 O00255 5/20 0.54
KMT2A Q03164 5/20 0.54
KDM4E B2RXH2 2/20 0.54
HSD17B10 Q99714 2/20 0.54
USP36 Q9P275 1/20 0.53
LMNA P02545 4/20 0.53
ALDH1A1 P00352 3/20 0.53
TP53 P04637 2/20 0.53
MAPK1 P28482 1/20 0.53
HTT P42858 3/20 0.53
KAT6A Q92794 1/20 0.52
MAPT P10636 3/20 0.51
MCL1 Q07820 1/20 0.51
MAPK14 Q16539 1/20 0.49
SMO Q99835 1/20 0.49
NPC1 O15118 2/20 0.49
RAB9A P51151 2/20 0.49
STAT3 P40763 1/20 0.49
HTR2B P41595 1/20 0.49

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
SCHEMBL1001379 0.87 MEN1 (0.66) SMN1; SMN2MEN1KMT2AKDM4EALDH1A1
SCHEMBL1001170 0.85 SMN1; SMN2 (0.64) SMN1; SMN2MEN1KMT2AKDM4ELMNA
SCHEMBL1002121 0.82 ALDH1A1 (0.54) SMN1; SMN2MEN1KMT2AKDM4EHSD17B10
SCHEMBL15277111 0.81 MEN1 (0.63) SMN1; SMN2MEN1KMT2ALMNAALDH1A1
SCHEMBL1001582 0.81 KMT2A (0.80) SMN1; SMN2MEN1KMT2AKDM4ELMNA
SCHEMBL1002080 0.81 HTR2B (0.53) SMN1; SMN2MEN1KMT2AKDM4EHSD17B10
SCHEMBL1002452 0.81 KMT2A (0.53) SMN1; SMN2MEN1KMT2AKDM4EHSD17B10
SCHEMBL1001301 0.81 NAMPT (0.60) SMN1; SMN2MEN1KMT2ALMNAALDH1A1
SCHEMBL15573630 0.80 MEN1 (0.69) SMN1; SMN2MEN1KMT2AMAPTNPC1
SCHEMBL999826 0.80 ALDH1A1 (0.48) SMN1; SMN2MEN1KMT2AKDM4EHSD17B10

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
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 SMN1; SMN2 965/4885MEN1 4600/4885KMT2A 473/4885

“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.