SCHEMBL1396567

SCHEMBL1396567

C=C(Cl)S(=O)(=O)c1ccccc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 4/20 0.48
ALDH1A1 P00352 4/20 0.48
HSD17B10 Q99714 2/20 0.48
TDP1 Q9NUW8 1/20 0.48
TSHR P16473 1/20 0.48
HTT P42858 4/20 0.47
DUSP3 P51452 1/20 0.46
PTPN5 P54829 1/20 0.46
PTPN11 Q06124 1/20 0.46
HTR6 P50406 1/20 0.46
LMNA P02545 3/20 0.44
MAPT P10636 3/20 0.44
CA1 P00915 2/20 0.43
CA2 P00918 2/20 0.43
MMP1 P03956 1/20 0.43
MMP2 P08253 1/20 0.43
MMP9 P14780 1/20 0.43
MMP8 P22894 1/20 0.43
MMP13 P45452 1/20 0.43
CA12 O43570 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
SCHEMBL10599045 0.82 SMN1; SMN2 (0.55) SMN1; SMN2ALDH1A1HSD17B10TDP1TSHR
SCHEMBL1319561 0.80 SMN1; SMN2 (0.52) SMN1; SMN2ALDH1A1HSD17B10TDP1TSHR
SCHEMBL9262998 0.78 SMN1; SMN2 (0.50) SMN1; SMN2ALDH1A1HSD17B10TDP1TSHR
SCHEMBL28235593 0.78 HTT (0.53) SMN1; SMN2ALDH1A1HSD17B10TDP1TSHR
SCHEMBL9484078 0.77 CA2 (0.53) SMN1; SMN2ALDH1A1TDP1TSHRHTR6
SCHEMBL10607916 0.76 SMN1; SMN2 (0.48) SMN1; SMN2ALDH1A1HSD17B10TDP1TSHR
SCHEMBL778407 0.76 SMN1; SMN2 (0.48) SMN1; SMN2ALDH1A1HSD17B10TDP1TSHR
SCHEMBL10692956 0.76 SMN1; SMN2 (0.48) SMN1; SMN2ALDH1A1HSD17B10TDP1TSHR
SCHEMBL9043625 0.76 SMN1; SMN2 (0.48) SMN1; SMN2ALDH1A1HSD17B10TDP1TSHR
SCHEMBL9077494 0.76 ALDH1A1 (0.43) SMN1; SMN2ALDH1A1HSD17B10TDP1TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10167313-B2 Selective caspase inhibitors and uses thereof GENESIS TECHNOLOGIES LIMITED (BB) 2019-01-01 US disclosed
EP-2288615-B1 SELECTIVE CASPASE INHIBITORS AND USES THEREOF GENESIS TECH LTD (BB) 2017-06-21 EP disclosed
US-20170114092-A1 SELECTIVE CASPASE INHIBITORS AND USES THEREOF GENESIS TECH LTD (BB) 2017-04-27 US disclosed
US-9562069-B2 Selective caspase inhibitors and uses thereof NEW WORLD LABORATORIES INC. (CA) 2017-02-07 US disclosed
CN-102105485-B Selectivity caspase inhibitors and uses thereof NEW WORLD LABORATORIES INC. (CA) 2016-01-13 CN disclosed
US-9045524-B2 Selective caspase inhibitors and uses thereof NOVAGENESIS FOUNDATION (CH) 2015-06-02 US disclosed
US-20150011458-A1 SELECTIVE CASPASE INHIBITORS AND USES THEREOF NEW WORLD LABORATORIES INC. (CA) 2015-01-08 US disclosed
US-8791235-B2 Selective caspase inhibitors and uses thereof NOVAGENESIS FOUNDATION (CH) 2014-07-29 US disclosed
US-20120157394-A1 SELECTIVE CASPASE INHIBITORS AND USES THEREOF NEW WORLD LABORATORIES, INC. (CA) 2012-06-21 US disclosed
CN-102105485-A Selective caspase inhibitors and uses thereof NEW WORLD LAB INC 2011-06-22 CN disclosed
US-20110077190-A1 Selective Caspase Inhibitors and Uses Thereof GENESIS TECHNOLOGIES LIMITED (BB) 2011-03-31 US disclosed
EP-2288615-A1 SELECTIVE CASPASE INHIBITORS AND USES THEREOF New World Laboratories Inc. (CA) 2011-03-02 EP disclosed
WO-2010133000-A1 SELECTIVE CASPASE INHIBITORS AND USES THEREOF NEW WORLD LABORATORIES INC. (CA) 2010-11-25 WO disclosed
WO-2009140765-A1 SELECTIVE CASPASE INHIBITORS AND USES THEREOF NEW WORLD LABORATORIES INC. (CA) 2009-11-26 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 (5 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-20110077190-A1 Selective Caspase Inhibitors and Uses Thereof CASP3, CASP1, HTRA2 SMN1; SMN2 214/4885ALDH1A1 1388/4885HSD17B10 699/4885
US-20150011458-A1 SELECTIVE CASPASE INHIBITORS AND USES THEREOF CASP3, CASP1, HTRA2 SMN1; SMN2 214/4885ALDH1A1 1388/4885HSD17B10 699/4885
US-20120157394-A1 SELECTIVE CASPASE INHIBITORS AND USES THEREOF CASP1, VIP, CASP5 SMN1; SMN2 211/4885ALDH1A1 4093/4885HSD17B10 1853/4885
US-20170114092-A1 SELECTIVE CASPASE INHIBITORS AND USES THEREOF CASP1, CASP3, CASP5 SMN1; SMN2 149/4885ALDH1A1 2471/4885HSD17B10 1083/4885
US-10167313-B2 Selective caspase inhibitors and uses thereof CASP1, CASP3, CASP5 SMN1; SMN2 149/4885ALDH1A1 2471/4885HSD17B10 1083/4885

“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.