SCHEMBL2732971

SCHEMBL2732971

O=C(NS(=O)(=O)c1cc(C(F)(F)F)ccc1Cl)c1cn2cc(Br)cnc2n1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.42
L3MBTL1 Q9Y468 2/20 0.42
LMNA P02545 2/20 0.42
GLA P06280 1/20 0.42
MEN1 O00255 3/20 0.39
KMT2A Q03164 3/20 0.39
KDM4E B2RXH2 1/20 0.39
HPGD P15428 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
MCL1 Q07820 2/20 0.38
TSHR P16473 1/20 0.36
ATM Q13315 1/20 0.36
MAPT P10636 1/20 0.36
ALKBH2 Q6NS38 1/20 0.36
ALKBH5 Q6P6C2 1/20 0.36
ALKBH3 Q96Q83 1/20 0.36
FTO Q9C0B1 1/20 0.36
PIK3CD O00329 1/20 0.36
PIK3CA P42336 1/20 0.36
PIK3CB P42338 1/20 0.36

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
SCHEMBL2723233 0.92 ALDH1A1 (0.45) ALDH1A1L3MBTL1LMNAGLAMEN1
SCHEMBL17788090 0.85 ALKBH2 (0.40) ALDH1A1L3MBTL1LMNAGLAMEN1
SCHEMBL16385359 0.85 ADORA2A (0.34) ALDH1A1LMNATDP1MAPTPIK3CD
SCHEMBL6403237 0.74 PTGS2 (0.52) KDM4EALKBH2ALKBH5FTO
SCHEMBL6404681 0.72 PTGS2 (0.50) HPGDALKBH2ALKBH5ALKBH3FTO
SCHEMBL22428154 0.72 ALDH1A1 (0.42) ALDH1A1L3MBTL1LMNAGLAMCL1
SCHEMBL2680314 0.71 ALDH1A1 (0.41) ALDH1A1L3MBTL1LMNAGLAMEN1
SCHEMBL22427968 0.71 ALDH1A1 (0.42) ALDH1A1L3MBTL1LMNAGLAMEN1
SCHEMBL2681649 0.71 ALDH1A1 (0.43) ALDH1A1LMNAMEN1KMT2AKDM4E
SCHEMBL2680256 0.70 SMN1; SMN2 (0.40) ALDH1A1L3MBTL1LMNAGLAMEN1

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 34 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2629614-B1 NEMATOCIDAL SULFONAMIDES DU PONT (US) 2014-09-17 EP claimed
US-20130190172-A1 NEMATOCIDAL SULFONAMIDES E I DU PONT DE NEMOURS AND COMPANY (US) 2013-07-25 US claimed
EP-3020715-B1 TETRAZOLINONE COMPOUND AND USE THEREOF SUMITOMO CHEMICAL CO (JP) 2021-06-16 EP disclosed
EP-3020715-B1 TETRAZOLINONE COMPOUND AND USE THEREOF SUMITOMO CHEMICAL CO (JP) 2021-06-16 EP disclosed
EP-3029030-B1 TETRAZOLINONE COMPOUND, AND USE THEREFOR SUMITOMO CHEMICAL CO (JP) 2019-09-04 EP disclosed
EP-3029038-B1 TETRAZOLINONE COMPOUND AND USE THEREOF SUMITOMO CHEMICAL CO (JP) 2019-03-27 EP disclosed
EP-3029038-B1 TETRAZOLINONE COMPOUND AND USE THEREOF SUMITOMO CHEMICAL CO (JP) 2019-03-27 EP disclosed
EP-3029035-B1 TETRAZOLINONE COMPOUND, AND USE THEREOF SUMITOMO CHEMICAL CO (JP) 2018-05-30 EP disclosed
US-9888688-B2 Tetrazolinone compounds and applications thereof SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2018-02-13 US disclosed
US-9888688-B2 Tetrazolinone compounds and applications thereof SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2018-02-13 US disclosed
US-9781933-B2 Tetrazolinone compound and use thereof SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2017-10-10 US disclosed
EP-3020715-A1 TETRAZOLINONE COMPOUND AND USE THEREOF Sumitomo Chemical Company Limited (JP) 2016-05-18 EP disclosed
US-9023850-B2 Nematocidal sulfonamides E I DU PONT DE NEMOURS AND COMPANY (US) 2015-05-05 US disclosed
WO-2015016335-A1 TETRAZOLINONE COMPOUND AND USE THEREOF 住友化学株式会社 (JP) 2015-02-05 WO disclosed
WO-2015016335-A1 TETRAZOLINONE COMPOUND AND USE THEREOF 住友化学株式会社 (JP) 2015-02-05 WO disclosed
WO-2015005499-A1 TETRAZOLINONE COMPOUND AND USE THEREOF 住友化学株式会社 (JP) 2015-01-15 WO disclosed
EP-2629614-B1 NEMATOCIDAL SULFONAMIDES DU PONT (US) 2014-09-17 EP disclosed
EP-2629614-A1 NEMATOCIDAL SULFONAMIDES E.I. Du Pont De Nemours And Company (US) 2013-08-28 EP disclosed
US-20130190172-A1 NEMATOCIDAL SULFONAMIDES E I DU PONT DE NEMOURS AND COMPANY (US) 2013-07-25 US disclosed
WO-2012054233-A1 NEMATOCIDAL SULFONAMIDES E. I. DU PONT DE NEMOURS AND COMPANY (US) 2012-04-26 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 (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-20130190172-A1 NEMATOCIDAL SULFONAMIDES QSOX1, ARSA, NOX1 ALDH1A1 703/4885L3MBTL1 723/4885LMNA 3746/4885

“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.