SCHEMBL672374

SCHEMBL672374

COC(c1ccc(Cl)cc1Cl)C(C)N

nearest known ligand 0.67

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
TP53 P04637 2/20 0.67
LMNA P02545 2/20 0.67
HTT P42858 1/20 0.67
IDO1 P14902 2/20 0.41
TDO2 P48775 1/20 0.41
CYP3A4 P08684 2/20 0.36
TSHR P16473 1/20 0.36
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
ADRB2 P07550 1/20 0.35
CYP1A2 P05177 1/20 0.35
CYP2D6 P10635 1/20 0.35
NFKB1 P19838 1/20 0.35
PNMT P11086 1/20 0.35
ESR1 P03372 1/20 0.35
ALDH1A1 P00352 1/20 0.34
GLA P06280 1/20 0.34

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
SCHEMBL3114962 1.00 TP53 (0.67) TP53LMNAHTTIDO1TDO2
SCHEMBL3122491 1.00 TP53 (0.67) TP53LMNAHTTIDO1TDO2
SCHEMBL3123826 1.00 TP53 (0.67) TP53LMNAHTTIDO1TDO2
SCHEMBL3126342 1.00 TP53 (0.67) TP53LMNAHTTIDO1TDO2
SCHEMBL13636282 0.85 TP53 (0.55) TP53LMNAHTTIDO1TDO2
SCHEMBL5492924 0.81 TP53 (1.00) TP53LMNAHTTIDO1TDO2
SCHEMBL3899828 0.81 TP53 (1.00) TP53LMNAHTTIDO1TDO2
SCHEMBL29723016 0.81 TP53 (1.00) TP53LMNAHTTIDO1TDO2
SCHEMBL3317981 0.81 TP53 (1.00) TP53LMNAHTTIDO1TDO2
SCHEMBL30542082 0.81 TP53 (1.00) TP53LMNAHTTIDO1TDO2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2507230-B1 INSECTICIDAL COMPOUNDS BASED ON ISOXAZOLINE DERIVATIVES SYNGENTA PARTICIPATIONS AG (CH) 2018-01-17 EP claimed
US-9192161-B2 Fungicidal combinations comprising a dithiino-tetracarboxamide fungicide BAYER INTELLECTUAL PROPERTY GMBH (DE) 2015-11-24 US claimed
US-20150119239-A1 AGROCHEMICAL COMPOSITIONS BASF SE (DE) 2015-04-30 US claimed
EP-2863749-A1 USE OF AN AGROCHEMICAL COMPOSITION WITH HERBICIDAL ACTION IN RAPESEED BASF SE (DE) 2015-04-29 EP claimed
US-20150051075-A1 USE OF AN AGROCHEMICAL COMPOSITION WITH HERBICIDAL ACTION IN SOYBEANS BASF SE (DE) 2015-02-19 US claimed
EP-2822387-A1 AGROCHEMICAL COMPOSITIONS BASF SE (DE) 2015-01-14 EP claimed
EP-2719280-A1 Use of N-phenylethylpyrazole carboxamide derivatives or salts thereof for resistance management of phytopathogenic fungi Bayer CropScience AG (DE) 2014-04-16 EP claimed
US-20140073503-A1 FUNGICIDAL COMBINATIONS COMPRISING A DITHIINO - TETRACARBOXAMIDE FUNGICIDE BAYER INTELLECTUAL PROPERTY GMBH (DE) 2014-03-13 US claimed
US-20140051735-A1 USE OF N-PHENYLETHYLPYRAZOLE CARBOXAMIDE DERIVATIVES OR SALTS THEREOF FOR CONTROLLING POWDERY MILDEW PRIMARY INFECTIONS BAYER INTELLECTUAL PROPERTY GMBH (DE) 2014-02-20 US claimed
EP-2688408-A2 FUNGICIDAL COMBINATIONS COMPRISING A DITHIINO-TETRACARBOXAMIDE FUNGICIDE Bayer CropScience AG (DE) 2014-01-29 EP claimed
WO-2013127821-A1 USE OF AN AGROCHEMICAL COMPOSITION WITH FUNGICIDAL AND PLANT HEALTH IMPROVING ACTION IN RAPESEED BASF SE (DE) 2013-09-06 WO claimed
WO-2013127861-A1 USE OF AN AGROCHEMICAL COMPOSITION WITH HERBICIDAL ACTION IN SOYBEANS BASF SE (DE) 2013-09-06 WO claimed
WO-2013127818-A1 USE OF AN AGROCHEMICAL COMPOSITION WITH FUNGICIDAL AND PLANT HEALTH IMPROVING ACTION IN SOYBEANS BASF SE (DE) 2013-09-06 WO claimed
WO-2013127845-A1 USE OF AN AGROCHEMICAL COMPOSITION WITH FUNGICIDAL, HERBICIDAL AND PLANT HEALTH IMPROVING ACTION IN SUNFLOWERS BASF SE (DE) 2013-09-06 WO claimed
EP-2155686-B1 PYRAZOLE CARBOXYLIC ACID AMIDES USEFUL AS MICROBIOCIDES SYNGENTA PARTICIPATIONS AG (CH) 2013-07-17 EP claimed
EP-2605656-A1 USE OF N-PHENYLETHYLPYRAZOLE CARBOXAMIDE DERIVATIVES OR SALTS THEREOF FOR CONTROLLING POWDERY MILDEW PRIMARY INFECTIONS Bayer Intellectual Property GmbH (DE) 2013-06-26 EP claimed
WO-2012130686-A2 ACTIVE COMPOUND COMBINATIONS BAYER CROPSCIENCE AG (DE) 2012-10-04 WO claimed
WO-2012022705-A1 USE OF N-PHENYLETHYLPYRAZOLE CARBOXAMIDE DERIVATIVES OR SALTS THEREOF FOR CONTROLLING POWDERY MILDEW PRIMARY INFECTIONS BAYER CROPSCIENCE AG (DE) 2012-02-23 WO claimed
US-20100324101-A1 Use of Succinate Dehydrogenase Inhibitors for Increasing the Resistance of Plants or Parts of Plants to Abiotic Stress BAYER CROPSCIENCE AG (DE) 2010-12-23 US claimed
WO-2010000612-A1 FUNGICIDAL COMPOSITIONS SYNGENTA PARTICIPATIONS AG (CH) 2010-01-07 WO 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 (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-20140073503-A1 FUNGICIDAL COMBINATIONS COMPRISING A DITHIINO - TETRACARBOXAMIDE FUNGICIDE DDT, TST, QDPR TP53 3500/4885LMNA 4207/4885HTT 1100/4885
US-20140051735-A1 USE OF N-PHENYLETHYLPYRAZOLE CARBOXAMIDE DERIVATIVES OR SALTS THEREOF FOR CONTROLLING POWDERY MILDEW PRIMARY INFECTIONS BROX, ME3, ME1 TP53 3717/4885LMNA 4802/4885HTT 4561/4885

“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.