SCHEMBL2929535

SCHEMBL2929535

CCOC(=O)c1[nH]c2cc(Br)c(Br)cc2c1S(=O)(=O)N1CCOCC1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 4/20 0.50
USP2 O75604 4/20 0.46
LMNA P02545 4/20 0.44
TSHR P16473 2/20 0.43
ALOX15 P16050 1/20 0.43
ALDH1A1 P00352 4/20 0.43
HSD17B10 Q99714 4/20 0.43
KDM4E B2RXH2 4/20 0.43
HPGD P15428 3/20 0.43
GAA P10253 2/20 0.43
NPSR1 Q6W5P4 1/20 0.42
MAPT P10636 6/20 0.42
MAPK1 P28482 4/20 0.42
TP53 P04637 2/20 0.42
MITF O75030 1/20 0.42
NTSR1 P30989 1/20 0.42
KMT2A Q03164 4/20 0.42
MEN1 O00255 3/20 0.41
TUBB4A P04350 1/20 0.40
TUBB P07437 1/20 0.40

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
SCHEMBL2929962 0.92 SMN1; SMN2 (0.47) SMN1; SMN2USP2LMNATSHRALOX15
SCHEMBL2924630 0.89 SMN1; SMN2 (0.47) SMN1; SMN2USP2LMNATSHRALOX15
SCHEMBL2924216 0.88 SMN1; SMN2 (0.53) SMN1; SMN2USP2LMNATSHRALDH1A1
SCHEMBL3043512 0.84 SMN1; SMN2 (0.54) SMN1; SMN2USP2LMNATSHRALDH1A1
SCHEMBL2930041 0.84 SMN1; SMN2 (0.53) SMN1; SMN2USP2LMNATSHRALDH1A1
SCHEMBL2931023 0.82 GAA (0.39) SMN1; SMN2LMNATSHRKDM4EGAA
SCHEMBL2925831 0.82 SMN1; SMN2 (0.49) SMN1; SMN2USP2LMNATSHRALOX15
SCHEMBL2929860 0.78 SMN1; SMN2 (0.47) SMN1; SMN2USP2LMNATSHRALOX15
SCHEMBL2876735 0.78 LMNA (0.56) SMN1; SMN2USP2LMNAALDH1A1HSD17B10
SCHEMBL2924910 0.77 SMN1; SMN2 (0.47) SMN1; SMN2USP2LMNATSHRALOX15

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 7 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
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 (2 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 SMN1; SMN2 4767/4885USP2 2116/4885LMNA 4850/4885
US-20090186871-A1 Tyrosine kinase inhibitors ABL1, JAK2, ERBB2 SMN1; SMN2 4767/4885USP2 2116/4885LMNA 4850/4885

“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.