SCHEMBL425389

SCHEMBL425389

Clc1cc(Cl)cc(-c2n[nH]cc2Cl)c1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.35
ALDH1A1 P00352 1/20 0.34
GFER P55789 1/20 0.34
RXFP1 Q9HBX9 1/20 0.34
KMO O15229 1/20 0.34
IDO1 P14902 1/20 0.33
ADORA2A P29274 2/20 0.33
ADORA1 P30542 2/20 0.33
ADORA2B P29275 1/20 0.33
MAPK13 O15264 2/20 0.32
RAF1 P04049 1/20 0.32
MAPK12 P53778 1/20 0.32
MAPK11 Q15759 1/20 0.32
MAPK14 Q16539 1/20 0.32
HPGD P15428 1/20 0.32
CDK1 P06493 1/20 0.30
PIM1 P11309 1/20 0.30
DYRK1A Q13627 1/20 0.30
PIM3 Q86V86 1/20 0.30
CLK4 Q9HAZ1 1/20 0.30

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
SCHEMBL8755909 0.87 MAP4K4 (0.34)
SCHEMBL8755813 0.87 CYP3A4 (0.41) ALDH1A1ADORA2AADORA1ADORA2B
SCHEMBL8755787 0.87 KDM1A (0.35) TSHRALDH1A1KMOHPGD
SCHEMBL8431067 0.87
SCHEMBL8427413 0.79 MAPK13 (0.33) TSHRALDH1A1GFERRXFP1IDO1
SCHEMBL8431053 0.79 HPGD (0.30) HPGD
SCHEMBL8755815 0.79 HPGD (0.30) HPGD
SCHEMBL8431445 0.78 ERBB2 (0.43) MAPK13MAPK12MAPK11MAPK14
SCHEMBL8756003 0.78
SCHEMBL8431291 0.76 PDGFRB (0.38) TSHRALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20130190178-A1 Pesticidal Treatment Compositions GOWAN COMERCIO INTEMACIONAL E SERVICOS LIMITADA (PT) 2013-07-25 US claimed
US-5945382-A AND A METHOD OF THEIR PREPARATION BY CHLORINATION OF AN INTERMEDIATE ARYLPYRAZOLE; PROTECTION AGAINST FUNGAL DISEASES IN TOMATO, RICE, AND WHEAT PLANTS RHONE-POULENC AGROCHIMIE (FR) 1999-08-31 US claimed
WO-1998043480-A1 FUNGICIDE COMPOSITIONS CONTAINING A 3-PHENYL-PYRAZOLE RHONE-POULENC AGRO (FR) 1998-10-08 WO claimed
US-RE47128-E1 Plant treatment compositions particularly effective in the control of Heteranthera limosa on rice crops, and methods for their use Canyon Group LLC (US) 2018-11-20 US disclosed
US-20170245492-A1 AGROCHEMICAL DELIVERY SYSTEM BASED ON ENZYME- OR pH- RESPONSIVE AMPHIPHILIC PEG-DENDRON HYBRIDS RAMOT AT TEL AVIV UNlVERSITY LTD. (IL) 2017-08-31 US disclosed
CN-107072193-A The agricultural chemicals delivery system of amphipathic PEG poplar bundles primitive hybrid based on enzyme response or pH responses 雷蒙特亚特特拉维夫大学有限公司 2017-08-18 CN disclosed
EP-3190880-A1 AGROCHEMICAL DELIVERY SYSTEM BASED ON ENZYME- OR pH- RESPONSIVE AMPHIPHILIC PEG-DENDRON HYBRIDS Ramot at Tel-Aviv University Ltd. (IL) 2017-07-19 EP disclosed
US-9585387-B1 PEHAM dendrimers for use in agriculture STARPHARMA PTY LTD (AU) 2017-03-07 US disclosed
US-9574109-B2 Surface-modified hydrogels and hydrogel microparticles DOW CORNING CORPORATION (US) 2017-02-21 US disclosed
CN-102762655-B Surface-modified hydrogels and hydrogel microparticles DOW CORNING CORP. (US) 2016-05-11 CN disclosed
WO-2016038596-A1 AGROCHEMICAL DELIVERY SYSTEM BASED ON ENZYME- OR pH- RESPONSIVE AMPHIPHILIC PEG-DENDRON HYBRIDS RAMOT AT TEL-AVIV UNIVERSITY LTD. (IL) 2016-03-17 WO disclosed
WO-2000053009-A1 PESTICIDE AND/OR PLANT GROWTH REGULATING COMPOSITIONS AVENTIS CROPSCIENCE S.A (FR) 2000-09-14 WO disclosed
US-5945382-A AND A METHOD OF THEIR PREPARATION BY CHLORINATION OF AN INTERMEDIATE ARYLPYRAZOLE; PROTECTION AGAINST FUNGAL DISEASES IN TOMATO, RICE, AND WHEAT PLANTS RHONE-POULENC AGROCHIMIE (FR) 1999-08-31 US disclosed
US-5856514-A Arylpyrazole fungicides RHONE-POULENC AGROCHIMIE (FR) 1999-01-05 US disclosed
WO-1998043480-A1 FUNGICIDE COMPOSITIONS CONTAINING A 3-PHENYL-PYRAZOLE RHONE-POULENC AGRO (FR) 1998-10-08 WO disclosed
US-5739153-A Arylpyrazole fungicides RHONE-POULENC AGROCHIMIE (FR) 1998-04-14 US disclosed
EP-0769905-A1 FUNGICIDAL COMPOSITIONS CONTAINING 3-PHENYL-PYRAZOLE DERIVATIVES FOR TREATING PROPAGATIVE PLANT STOCK, NOVEL 3-PHENYL-PYRAZOLE DERIVATIVES, AND FUNGICIDAL USES THEREOF RHONE-POULENC AGROCHIMIE (FR) 1997-05-02 EP disclosed
WO-1996002138-A1 FUNGICIDAL COMPOSITIONS CONTAINING 3-PHENYL-PYRAZOLE DERIVATIVES FOR TREATING PROPAGATIVE PLANT STOCK, NOVEL 3-PHENYL-PYRAZOLE DERIVATIVES, AND FUNGICIDAL USES THEREOF RHONE POULENC AGROCHIMIE (FR) 1996-02-01 WO disclosed
EP-0638070-A1 FUNGICIDAL ARYLPYRAZOLES RHONE-POULENC AGROCHIMIE (FR) 1995-02-15 EP disclosed
WO-1993022287-A1 FUNGICIDAL ARYLPYRAZOLES RHONE POULENC AGROCHIMIE (FR) 1993-11-11 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 (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-20130190178-A1 Pesticidal Treatment Compositions DDT, CHIT1, CTRL TSHR 1437/4885ALDH1A1 3481/4885GFER 3371/4885
US-20170245492-A1 AGROCHEMICAL DELIVERY SYSTEM BASED ON ENZYME- OR pH- RESPONSIVE AMPHIPHILIC PEG-DENDRON HYBRIDS APEH, JMJD7, AGL TSHR 4251/4885ALDH1A1 828/4885GFER 625/4885

“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.