SCHEMBL341019

SCHEMBL341019

COC(=O)c1cc(-c2ccccc2)n(-c2ccccc2Cl)n1

nearest known ligand 0.62

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
RXRA P19793 1/20 0.62
NR1H2 P55055 1/20 0.62
NR1H3 Q13133 1/20 0.62
ALDH1A1 P00352 1/20 0.56
MARS1 P56192 4/20 0.56
MAPT P10636 1/20 0.53
HTT P42858 1/20 0.53
RPA1 P27694 4/20 0.50
MALT1 Q9UDY8 2/20 0.50
SMN1; SMN2 Q16637 1/20 0.50
FABP3 P05413 1/20 0.50
FABP4 P15090 1/20 0.50
SLC16A3 O15427 2/20 0.48
SMPD1 P17405 1/20 0.48
SLC16A1 P53985 1/20 0.47
MEN1 O00255 1/20 0.47
KMT2A Q03164 1/20 0.47

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
SCHEMBL29419072 1.00 RXRA (0.62) RXRANR1H2NR1H3ALDH1A1MARS1
SCHEMBL9418677 0.89 MARS1 (0.72) RXRANR1H2NR1H3ALDH1A1MARS1
SCHEMBL31130354 0.88 SLC16A3 (0.59) RXRANR1H2NR1H3ALDH1A1MARS1
SCHEMBL15456724 0.86 CA9 (0.60) RXRANR1H2NR1H3ALDH1A1MARS1
SCHEMBL1831165 0.85 MARS1 (0.74) ALDH1A1MARS1MAPTHTTRPA1
SCHEMBL31130410 0.84 SLC16A3 (0.61) RXRANR1H2NR1H3MARS1SMN1; SMN2
SCHEMBL9630621 0.84 MARS1 (0.61) ALDH1A1MARS1MAPTHTTRPA1
Hydrochloric Acid SCHEMBL9630623 0.84 MARS1 (0.72) ALDH1A1MARS1MAPTHTTRPA1
SCHEMBL3471987 0.84 RXRA (0.50) RXRANR1H2NR1H3ALDH1A1MARS1
SCHEMBL15229859 0.83 RXRA (0.50) RXRANR1H2NR1H3ALDH1A1MARS1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2099751-B1 BIPHENYL-SUBSTITUTED SPIROCYCLIC KETOENOLS BAYER IP GMBH (DE) 2018-05-30 EP claimed
CN-101160049-B Spiroketal-substituted cyclic ketoenols BAYER INTELLECTUAL PROPERTY GMBH (DE) 2016-05-11 CN claimed
US-20160000076-A1 Fungicidal Active Compound Combinations BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) 2016-01-07 US claimed
EP-2185563-B1 OXASPIROCYCLIC SPIRO-SUBSTITUTED TETRAMIC AND TETRONIC ACID DERIVATIVES BAYER IP GMBH (DE) 2015-08-19 EP claimed
EP-1943218-B1 ALKOXYALKYL SPIROCYCLIC TETRAMIC ACIDS AND TETRONIC ACIDS BAYER IP GMBH (DE) 2015-05-06 EP claimed
US-8993782-B2 Cis-alkoxyspirocyclic biphenyl-substituted tetramic acid derivatives BAYER CROPSCIENCE AG (DE) 2015-03-31 US claimed
EP-2195290-B1 HALOGEN ALKOXY SPIROCYCLIC TETRAMIC AND TETRONIC ACID DERIVATIVES BAYER IP GMBH (DE) 2015-03-11 EP claimed
EP-1552746-B1 Selective heteroaryloxy-acetamide-based herbicides BAYER IP GMBH (DE) 2015-02-11 EP claimed
EP-2243362-B1 Selective heteroaryloxy-acetamide-based herbicides BAYER CROPSCIENCE AG (DE) 2014-12-24 EP claimed
EP-2243361-B1 Selective heteroaryloxy-acetamide-based herbicides BAYER CROPSCIENCE AG (DE) 2014-11-26 EP claimed
US-20040102321-A1 Selective heteroaryloxy- acetamides-based herbicides BAYER INTELLECTUAL PROPERTY GMBH (DE) 2004-05-27 US claimed
US-20030211942-A1 Aryl sulfonyl amino carbonyl triazole based selective herbicides BAYER INTELLECTUAL PROPERTY GMBH (DE) 2003-11-13 US claimed
CN-1391441-A Carbamoyl triazolinone based herbicides BAYER AG (DE) 2003-01-15 CN claimed
US-5371060-A PREFERENTIAL WEED CONTROL CIBA-GEIGY CORPORATION (US) 1994-12-06 US claimed
EP-0558448-A1 1,5-diphenylpyrazole-3-carboxylic acid derivatives as antidotes for sulfonylurea herbicides CIBA-GEIGY AG (CH) 1993-09-01 EP claimed
US-5114462-A Herbicides as plant growth regulators, phenoxypropionic acid esters and derivatives CIBA-GEIGY CORPORATION (US) 1992-05-19 US claimed
US-5078780-A Plant safening agents for use with herbicides CIBA-GEIGY CORPORATION (US) 1992-01-07 US claimed
EP-0268554-B1 1,5-DIPHENYL PYRAZOLE-3-CARBONIC-ACID DERIVATIVES FOR THE PROTECTION OF CULTURED PLANTS CIBA-GEIGY AG (CH) 1991-12-27 EP claimed
US-4944790-A PLANT SAFENING AGENTS FOR USE WITH CERTAIN HERBICIDES CIBA-GEIGY CORPORATION (US) 1990-07-31 US claimed
EP-0268554-A2 1,5-Diphenyl pyrazole-3-carbonic-acid derivatives for the protection of cultured plants CIBA-GEIGY AG (CH) 1988-05-25 EP claimed

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-20040102321-A1 Selective heteroaryloxy- acetamides-based herbicides AADAC, HACL2, HDHD5 RXRA 1325/4885NR1H2 2141/4885NR1H3 2610/4885
US-20030211942-A1 Aryl sulfonyl amino carbonyl triazole based selective herbicides AADAC, CBR3, ABAT RXRA 2233/4885NR1H2 3562/4885NR1H3 3942/4885
US-20160000076-A1 Fungicidal Active Compound Combinations DDT, CYP4X1, CYP51A1 RXRA 1303/4885NR1H2 2568/4885NR1H3 2945/4885

“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.