SCHEMBL166859

SCHEMBL166859

Cn1c(=O)c(-c2cccs2)nc2ccccc21

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 10/20 0.64
KDM4E B2RXH2 4/20 0.64
RAB9A P51151 3/20 0.64
NPC1 O15118 2/20 0.64
SMN1; SMN2 Q16637 2/20 0.64
GAA P10253 2/20 0.61
HPGD P15428 2/20 0.61
CASP1 P29466 10/20 0.59
CASP7 P55210 10/20 0.59
CYP1A2 P05177 9/20 0.59
HSD17B10 Q99714 9/20 0.59
HIF1A Q16665 8/20 0.59
USP2 O75604 8/20 0.59
MEN1 O00255 7/20 0.59
KMT2A Q03164 7/20 0.59
CYP3A4 P08684 6/20 0.59
CYP2C9 P11712 6/20 0.59
CLK4 Q9HAZ1 2/20 0.59
MAPT P10636 3/20 0.56
KLK7 P49862 1/20 0.56

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
SCHEMBL29419105 1.00 ALDH1A1 (0.64) ALDH1A1KDM4ERAB9ANPC1SMN1; SMN2
SCHEMBL1963785 0.82 ADORA2A (0.55) ALDH1A1KDM4ERAB9ANPC1SMN1; SMN2
SCHEMBL29419121 0.82 KDM4E (0.64) ALDH1A1KDM4ERAB9ANPC1SMN1; SMN2
SCHEMBL692481 0.82 KDM4E (0.64) ALDH1A1KDM4ERAB9ANPC1SMN1; SMN2
SCHEMBL15774206 0.82 ALDH1A1 (0.67) ALDH1A1KDM4ERAB9ANPC1SMN1; SMN2
SCHEMBL12553801 0.80 ALDH1A1 (0.51) ALDH1A1KDM4ERAB9ANPC1SMN1; SMN2
Benzene SCHEMBL1904094 0.80 ADORA2A (0.53) ALDH1A1KDM4ERAB9ANPC1SMN1; SMN2
Hydrochloric Acid SCHEMBL167760 0.79 ALDH1A1 (0.50) ALDH1A1KDM4ERAB9ANPC1SMN1; SMN2
Hydrochloric Acid SCHEMBL29419155 0.79 ALDH1A1 (0.50) ALDH1A1KDM4ERAB9ANPC1SMN1; SMN2
SCHEMBL982188 0.78 KDM4E (1.00) ALDH1A1KDM4ERAB9ANPC1SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2334175-B1 PHENYL-SUBSTITUTED BICYCLOOCTANE 1,3 DIONE DERIVATIVES BAYER IP GMBH (DE) 2017-03-01 EP claimed
EP-2635550-B1 PHENYL-SUBSTITUTED BICYCLOOCTANE-1,3-DIONE-DERIVATIVES BAYER IP GMBH (DE) 2016-01-27 EP claimed
US-9204640-B2 2-acyloxy-pyrrolin-4-ones BAYER INTELLECTUAL PROPERTY GMBH (DE) 2015-12-08 US claimed
US-9198432-B2 1,2,4-triazolyl-substituted ketoenols BAYER INTELLECTUAL PROPERTY GMBH (DE) 2015-12-01 US claimed
EP-2681191-B1 2-ACYLOXY-PYRROLIN-4-ONES BAYER IP GMBH (DE) 2015-09-02 EP claimed
EP-2534147-B1 SPIROHETEROCYCLIC-SUBSTITUTED TETRAMIC ACID DERIVATIVES BAYER IP GMBH (DE) 2015-06-17 EP claimed
US-8946124-B2 Substituted 3-(biphenyl-3-yl)-8,8-difluoro-4-hydroxy-1-azaspiro[4.5]dec-3-en-2-ones for therapy and halogen-substituted spirocyclic ketoenols BAYER INTELLECTUAL PROPERTY GMBH (DE) 2015-02-03 US claimed
WO-2011138280-A2 HERBICIDE/SAFENER COMBINATIONS COMPRISING ARYLPYRIDAZINONES AND SAFENER BAYER CROPSCIENCE AG (DE) 2011-11-10 WO claimed
EP-2210492-A1 Herbicide safener combination Bayer CropScience AG (DE) 2010-07-28 EP claimed
EP-2191719-A1 Herbicide safener combination Bayer CropScience AG (DE) 2010-06-02 EP claimed
EP-2191716-A1 Herbicide safener combination Bayer CropScience AG (DE) 2010-06-02 EP claimed
US-20260144250-A1 SOLVENT-FREE FORMULATIONS OF LOW-MELTING ACTIVE INGREDIENTS BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) 2026-05-28 US disclosed
US-20260138958-A1 SUBSTITUTED N-PHENYLURACILS AND SALTS THEREOF, AND USE THEREOF AS HERBICIDAL ACTIVE SUBSTANCES BAYER AG (DE) 2026-05-21 US disclosed
US-12599136-B2 Substituted isophthalic acid diamides and their use as herbicides BAYER AKTIENGESELLSCHAFT (DE) 2026-04-14 US disclosed
EP-4680598-A1 4-DIFLUOROMETHYL BENZAMIDES WITH HERBICIDAL ACTION Bayer Aktiengesellschaft (DE) 2026-01-21 EP disclosed
EP-2052614-A1 Herbicide combination Bayer CropScience AG (DE) 2009-04-29 EP disclosed
EP-2052605-A1 Herbicide combination Bayer CropScience AG (DE) 2009-04-29 EP disclosed
EP-1746880-A1 QUINOXALIN-2-ONE DERIVATIVES CROP PROTECTION AGENTS COMPRISING THE SAME AND METHOD FOR PRODUCTION AND USE THEROF Bayer CropScience GmbH (DE) 2007-01-31 EP disclosed
WO-2005112630-A1 QUINOXALIN-2-ONE DERIVATIVES CROP PROTECTION AGENTS COMPRISING THE SAME AND METHOD FOR PRODUCTION AND USE THEROF BAYER CROPSCIENCE GMBH (DE) 2005-12-01 WO disclosed
US-20050256000-A1 Quinoxalin-2-one derivatives, compositions which protect useful plants and comprise these derivatives, and processes for their preparation and their use BAYER CROPSCIENCE GMBH (DE) 2005-11-17 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 (4 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-20260138958-A1 SUBSTITUTED N-PHENYLURACILS AND SALTS THEREOF, AND USE THEREOF AS HERBICIDAL ACTIVE SUBSTANCES CBR1, CBR3, HDHD5 ALDH1A1 148/4885KDM4E 3156/4885RAB9A 1658/4885
US-20260144250-A1 SOLVENT-FREE FORMULATIONS OF LOW-MELTING ACTIVE INGREDIENTS FOXM1, CSDE1, RCC1 ALDH1A1 692/4885KDM4E 1585/4885RAB9A 3200/4885
US-20050256000-A1 Quinoxalin-2-one derivatives, compositions which protect useful plants and comprise these derivatives, and processes for their preparation and their use QSOX1, CYC1, CBR3 ALDH1A1 1058/4885KDM4E 2003/4885RAB9A 1345/4885
US-12599136-B2 Substituted isophthalic acid diamides and their use as herbicides P4HA1, DDT, CNPY2 ALDH1A1 2004/4885KDM4E 2659/4885RAB9A 4488/4885

“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.