SCHEMBL2303571

SCHEMBL2303571

CC(=O)c1ccccc1Oc1ccc(Cl)cc1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.60
ATM Q13315 2/20 0.54
L3MBTL1 Q9Y468 2/20 0.54
HTT P42858 2/20 0.54
ALDH1A1 P00352 2/20 0.54
GAA P10253 1/20 0.54
HPGD P15428 1/20 0.54
PNLIP P16233 8/20 0.53
MEN1 O00255 2/20 0.52
KMT2A Q03164 2/20 0.52
CTNNB1 P35222 1/20 0.50
BRD4 O60885 1/20 0.48
CYP1A2 P05177 1/20 0.48
CYP2C9 P11712 1/20 0.48
CYP2C19 P33261 1/20 0.48
NPSR1 Q6W5P4 1/20 0.48
LMNA P02545 2/20 0.48
HTR2A P28223 2/20 0.47
SLC6A4 P31645 2/20 0.47
SLC6A2 P23975 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
SCHEMBL9638920 0.91 CTNNB1 (0.58) MAPTL3MBTL1HTTALDH1A1GAA
SCHEMBL29679671 0.85 CTNNB1 (0.67) MAPTL3MBTL1HTTALDH1A1GAA
SCHEMBL3179214 0.85 CTNNB1 (0.67) MAPTL3MBTL1HTTALDH1A1GAA
SCHEMBL11604077 0.84 CTNNB1 (0.51) MAPTL3MBTL1HTTALDH1A1GAA
SCHEMBL19524204 0.84 SCN8A (0.53) MAPTL3MBTL1ALDH1A1GAAPNLIP
SCHEMBL2778881 0.84 MAPT (0.61) MAPTATML3MBTL1HTTALDH1A1
SCHEMBL29842430 0.84 MAPT (0.61) MAPTATML3MBTL1HTTALDH1A1
SCHEMBL4743129 0.84 MAPT (0.62) MAPTL3MBTL1HTTALDH1A1GAA
Hydrochloric Acid SCHEMBL8136102 0.84 CTNNB1 (0.65) MAPTL3MBTL1HTTALDH1A1GAA
SCHEMBL4155484 0.83 CTNNB1 (0.74) MAPTATML3MBTL1HTTALDH1A1

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 10 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3712135-B1 AZOLE DERIVATIVE, INTERMEDIATE COMPOUND, METHOD FOR PRODUCING AZOLE DERIVATIVE, AGENT FOR AGRICULTURAL AND HORTICULTURAL USE, AND MATERIAL PROTECTION AGENT FOR INDUSTRIAL USE KUREHA CORP (JP) 2023-05-03 EP disclosed
CN-111032631-B Azole derivative, intermediate compound, process for producing azole derivative, agricultural and horticultural chemical, and industrial material protective agent 株式会社吴羽 2021-05-07 CN disclosed
US-10945434-B2 Azole derivative, intermediate compound, method for producing azole derivative, agricultural or horticultural chemical agent, and protective agent for industrial material KUREHA CORPORATION (JP) 2021-03-16 US disclosed
EP-3712135-A1 AZOLE DERIVATIVE, INTERMEDIATE COMPOUND, METHOD FOR PRODUCING AZOLE DERIVATIVE, AGENT FOR AGRICULTURAL AND HORTICULTURAL USE, AND MATERIAL PROTECTION AGENT FOR INDUSTRIAL USE Kureha Corporation (JP) 2020-09-23 EP disclosed
US-20200288714-A1 AZOLE DERIVATIVE, INTERMEDIATE COMPOUND, METHOD FOR PRODUCING AZOLE DERIVATIVE, AGRICULTURAL OR HORTICULTURAL CHEMICAL AGENT, AND PROTECTIVE AGENT FOR INDUSTRIAL MATERIAL KUREHA CORPORATION (JP) 2020-09-17 US disclosed
CN-111032631-A Azole derivative, intermediate compound, process for producing azole derivative, agricultural and horticultural chemical, and industrial material protective agent 株式会社吴羽 2020-04-17 CN disclosed
EP-2349999-A1 ALLOSTERIC PROTEIN KINASE MODULATORS Universität des Saarlandes (DE) 2011-08-03 EP disclosed
WO-2010043711-A1 ALLOSTERIC PROTEIN KINASE MODULATORS UNIVERSITAET DES SAARLANDES (DE) 2010-04-22 WO disclosed
CN-87108295-A New alkane sulfonyl aniline derivative and its medicinal compositions and preparation method 1988-07-13 CN disclosed
US-4287213-A Dichloroacyl diphenyl ether mite ovacides CHEVRON RESEARCH COMPANY (US) 1981-09-01 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 (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-10945434-B2 Azole derivative, intermediate compound, method for producing azole derivative, agricultural or horticultural chemical agent, and protective agent for industrial material NOS2, NOS1, CYP51A1 MAPT 1522/4885ATM 1248/4885L3MBTL1 2015/4885
US-20200288714-A1 AZOLE DERIVATIVE, INTERMEDIATE COMPOUND, METHOD FOR PRODUCING AZOLE DERIVATIVE, AGRICULTURAL OR HORTICULTURAL CHEMICAL AGENT, AND PROTECTIVE AGENT FOR INDUSTRIAL MATERIAL NOS2, NOS1, CYP51A1 MAPT 1522/4885ATM 1248/4885L3MBTL1 2015/4885

“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.