SCHEMBL1001283

SCHEMBL1001283

COc1cccnc1NC(=O)c1cccc(S(=O)(=O)N2CCCC(c3nc4ccccc4[nH]3)C2)c1

nearest known ligand 0.54

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 7/20 0.54
MEN1 O00255 5/20 0.48
GAA P10253 3/20 0.48
SMN1; SMN2 Q16637 3/20 0.48
HPGD P15428 2/20 0.48
CLK1 P49759 1/20 0.48
KDM4E B2RXH2 2/20 0.48
MAPT P10636 3/20 0.44
ALDH1A1 P00352 1/20 0.44
TSHR P16473 2/20 0.44
HTT P42858 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
LMNA P02545 1/20 0.44

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
SCHEMBL1000751 0.81 KMT2A (0.55) KMT2AMEN1GAASMN1; SMN2HPGD
SCHEMBL1000611 0.81 MEN1 (0.51) KMT2AMEN1GAASMN1; SMN2ALDH1A1
SCHEMBL1000769 0.80 MEN1 (0.65) KMT2AMEN1GAASMN1; SMN2KDM4E
SCHEMBL1000551 0.80 LMNA (0.51) KMT2AMEN1SMN1; SMN2ALDH1A1TSHR
SCHEMBL1001634 0.80 LMNA (0.51) KMT2AMEN1GAASMN1; SMN2KDM4E
SCHEMBL1001588 0.79 MEN1 (0.67) KMT2AMEN1GAASMN1; SMN2KDM4E
SCHEMBL1000768 0.79 ALDH1A1 (0.58) KMT2AMEN1GAASMN1; SMN2KDM4E
SCHEMBL1003224 0.77 L3MBTL1 (0.60) KMT2AMEN1MAPTALDH1A1HTT
SCHEMBL1001640 0.77 CYP2C19 (0.49) GAASMN1; SMN2KDM4EMAPTALDH1A1
SCHEMBL1001317 0.76 KMT2A (0.52) KMT2AMEN1GAASMN1; SMN2HPGD

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-2280001-B1 LONG-CHAIN FATTY ACID ELONGATION ENZYME INHIBITOR COMPRISING ARYLSULFONYL DERIVATIVE AS ACTIVE INGREDIENT MSD KK (JP) 2014-10-15 EP claimed
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 KMT2A 473/4885MEN1 4600/4885GAA 607/4885

“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.