SCHEMBL2928016

SCHEMBL2928016

CCOC(=O)c1c(S(=O)(=O)N2CCOCC2)c2cc(Br)ccc2n1S(=O)(=O)c1ccccc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 5/20 0.47
SMN1; SMN2 Q16637 4/20 0.47
MAPT P10636 4/20 0.47
LMNA P02545 4/20 0.47
USP2 O75604 3/20 0.47
MEN1 O00255 3/20 0.47
MAPK1 P28482 3/20 0.47
ALDH1A1 P00352 1/20 0.47
TP53 P04637 1/20 0.47
GAA P10253 1/20 0.47
HPGD P15428 2/20 0.46
NPC1 O15118 1/20 0.45
ELANE P08246 1/20 0.43
HSD17B10 Q99714 3/20 0.43
KDM4E B2RXH2 1/20 0.43
TSHR P16473 2/20 0.43
ATM Q13315 1/20 0.43
NPSR1 Q6W5P4 1/20 0.42
CREBBP Q92793 1/20 0.42
RECQL P46063 1/20 0.42

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
SCHEMBL2929041 0.89 SMN1; SMN2 (0.47) KMT2ASMN1; SMN2MAPTLMNAUSP2
Hydrochloric Acid SCHEMBL2922661 0.89 ELANE (0.43) KMT2AMEN1MAPK1ALDH1A1NPC1
SCHEMBL2924410 0.87 ALDH1A1 (0.45) KMT2ASMN1; SMN2MAPTLMNAMEN1
SCHEMBL2929649 0.85 RAB9A (0.43) KMT2ASMN1; SMN2LMNAMEN1MAPK1
SCHEMBL2924748 0.84 ACLY (0.45) KMT2ASMN1; SMN2MAPTMEN1MAPK1
SCHEMBL2345364 0.84 ELANE (0.48) SMN1; SMN2MAPTLMNAALDH1A1ELANE
SCHEMBL2350038 0.79 ELANE (0.43) KMT2ASMN1; SMN2MAPTLMNAALDH1A1
SCHEMBL2346554 0.79 SMN1; SMN2 (0.44) SMN1; SMN2MAPTLMNAUSP2ALDH1A1
Hydrochloric Acid SCHEMBL2349568 0.78 ELANE (0.43) SMN1; SMN2MAPTLMNAALDH1A1ELANE
SCHEMBL13765375 0.78 MEN1 (0.45) KMT2ASMN1; SMN2MAPTMEN1MAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1534695-B1 TYROSINE KINASE INHIBITORS MERCK SHARP & DOHME (US) 2010-09-29 EP disclosed
US-20090186871-A1 Tyrosine kinase inhibitors MERCK SHARP & DOHME CORP. 2009-07-23 US disclosed
US-7560546-B2 Tyrosine kinase inhibitors MERCK & CO., INC. (US) 2009-07-14 US disclosed
EP-1534695-A4 TYROSINE KINASE INHIBITORS MERCK & CO INC (US) 2008-06-11 EP disclosed
US-20050261496-A1 Tyrosine kinase inhibitors MERCK SHARP & DOHME LLC 2005-11-24 US disclosed
EP-1534695-A2 TYROSINE KINASE INHIBITORS Merck & Co., Inc. (US) 2005-06-01 EP disclosed
US-20040102360-A1 Combination therapy BARNETT STANLEY F (US) 2004-05-27 US disclosed
WO-2004014851-A2 TYROSINE KINASE INHIBITORS MERCK & CO., INC. (US) 2004-02-19 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 (3 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-20050261496-A1 Tyrosine kinase inhibitors ABL1, JAK2, ERBB2 KMT2A 1038/4885SMN1; SMN2 4767/4885MAPT 2505/4885
US-20040102360-A1 Combination therapy MTOR, AKT2, PLK1 KMT2A 1485/4885SMN1; SMN2 3396/4885MAPT 3086/4885
US-20090186871-A1 Tyrosine kinase inhibitors ABL1, JAK2, ERBB2 KMT2A 1038/4885SMN1; SMN2 4767/4885MAPT 2505/4885

“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.