SCHEMBL4728147

SCHEMBL4728147

Cc1cc(N)c(Cl)cc1Br

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CD44 P16070 1/20 0.52
GAA P10253 1/20 0.50
CYP3A4 P08684 6/20 0.46
TSHR P16473 5/20 0.46
MAPK1 P28482 2/20 0.46
NPC1 O15118 1/20 0.40
ALDH1A1 P00352 5/20 0.38
TDP1 Q9NUW8 1/20 0.36
TP53 P04637 1/20 0.36
AHR P35869 3/20 0.34
CA12 O43570 2/20 0.33
CA1 P00915 2/20 0.33
CA2 P00918 2/20 0.33
CA7 P43166 2/20 0.33
CA9 Q16790 2/20 0.33
CA14 Q9ULX7 2/20 0.33
UHRF1 Q96T88 1/20 0.33
CYP1A2 P05177 1/20 0.33
ALOX15 P16050 1/20 0.33
CASP7 P55210 1/20 0.33

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
SCHEMBL3365801 0.91 GAA (0.50) CD44GAACYP3A4TSHRMAPK1
SCHEMBL2026149 0.82 GAA (0.67) CD44GAACYP3A4TSHRMAPK1
SCHEMBL29683620 0.82 GAA (0.67) CD44GAACYP3A4TSHRMAPK1
SCHEMBL14272795 0.81 CD44 (0.65) CD44GAACYP3A4TSHRMAPK1
Hydrochloric Acid SCHEMBL8647129 0.80 CD44 (0.64) CD44GAACYP3A4TSHRMAPK1
Hydrochloric Acid SCHEMBL8647124 0.80 CD44 (0.64) CD44GAACYP3A4TSHRMAPK1
SCHEMBL272760 0.79 CYP3A4 (0.63) CD44GAACYP3A4TSHRMAPK1
SCHEMBL3046974 0.79 CYP3A4 (0.55) CD44GAACYP3A4TSHRMAPK1
SCHEMBL16282614 0.79 CD44 (0.62) CD44GAACYP3A4TSHRMAPK1
SCHEMBL21404025 0.79 AHR (0.40) CD44CYP3A4TSHRMAPK1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240023549-A1 FUNGICIDAL ARYL AMIDINES CORTEVA AGRISCIENCE LLC (US) 2024-01-25 US disclosed
US-20240023549-A1 FUNGICIDAL ARYL AMIDINES CORTEVA AGRISCIENCE LLC (US) 2024-01-25 US disclosed
US-20240023549-A1 FUNGICIDAL ARYL AMIDINES CORTEVA AGRISCIENCE LLC (US) 2024-01-25 US disclosed
EP-3525589-B1 4-ARYLAMINO SUBSTITUTED PHENYLAMIDINE DERIVATIVES AND THEIR USE TO PROTECT CROPS BY FIGHTING UNDESIRED PHYTOPATHOGENIC MICOORGANISMS PI INDUSTRIES LTD (IN) 2023-12-06 EP disclosed
EP-4247789-A1 FUNGICIDAL ARYL AMIDINES Corteva Agriscience LLC (US) 2023-09-27 EP disclosed
CN-116529235-A Fungicidal aryl amidines 科迪华农业科技有限责任公司 2023-08-01 CN disclosed
WO-2023047285-A1 A PROCESS FOR PREPARING PHENYLAMIDINE COMPOUNDS AND INTERMEDIATES THEREOF PI INDUSTRIES LIMITED (IN) 2023-03-30 WO disclosed
WO-2023007408-A1 4-SUBSTITUTED ARYLAMIDINE COMPOUNDS AS FUNGICIDES PI INDUSTRIES LTD. (IN) 2023-02-02 WO disclosed
US-20220220068-A1 FUNGICIDAL ARYL AMIDINES CORTEVA AGRISCIENCE LLC (US) 2022-07-14 US disclosed
WO-2022109362-A1 FUNGICIDAL ARYL AMIDINES CORTEVA AGRISCIENCE LLC (US) 2022-05-27 WO disclosed
WO-2020237131-A1 FUNGICIDAL ARYL AMIDINES DOW AGROSCIENCES LLC (US) 2020-11-26 WO disclosed
WO-2020157710-A1 4-SUBSTITUTED ISOXAZOLE/ISOXAZOLINE (HETERO) ARYLAMIDINE COMPOUNDS, PREPARATION AND USE THEREOF PI INDUSTRIES LTD. (IN) 2020-08-06 WO disclosed
EP-3555044-A1 PHENYLAMIDINES AND THE USE THEREOF AS FUNGICIDES Bayer CropScience Aktiengesellschaft (DE) 2019-10-23 EP disclosed
US-20190308933-A1 PHENYLAMIDINES AND THE USE THEREOF AS FUNGICIDES BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) 2019-10-10 US disclosed
EP-3525589-A1 4-AMINO SUBSTITUTED PHENYLAMIDINE DERIVATIVES AND THEIR USE TO PROTECT CROPS BY FIGHTING UNDESIRED PHYTOPATHOGENIC MICOORGANISMS PI Industries Ltd (IN) 2019-08-21 EP disclosed
WO-2018108998-A1 PHENYLAMIDINES AND THE USE THEREOF AS FUNGICIDES BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) 2018-06-21 WO disclosed
WO-2018069842-A1 4-AMINO SUBSTITUTED PHENYLAMIDINE DERIVATIVES AND THEIR USE TO PROTECT CROPS BY FIGHTING UNDESIRED PHYTOPATHOGENIC MICOORGANISMS PI INDUSTRIES LTD (IN) 2018-04-19 WO disclosed
US-9260414-B2 Inhibitors of hepatitic C virus THERAVANCE BIOPHARMA R&D IP, LLC (US) 2016-02-16 US disclosed
US-20150071878-A1 NOVEL INHIBITORS OF HEPATITIC C VIRUS THERAVANCE BIOPHARMA R&D IP, LLC (US) 2015-03-12 US disclosed
US-20120114600-A1 NOVEL INHIBITORS OF HEPATITIS C VIRUS THERAVANCE, INC. (US) 2012-05-10 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 (5 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-20220220068-A1 FUNGICIDAL ARYL AMIDINES CYP1A1, CYP1A2, CYP1B1 CD44 4844/4885GAA 512/4885CYP3A4 27/4885
US-20190308933-A1 PHENYLAMIDINES AND THE USE THEREOF AS FUNGICIDES PAH, PFAS, DPM1 CD44 4809/4885GAA 169/4885CYP3A4 24/4885
US-20150071878-A1 NOVEL INHIBITORS OF HEPATITIC C VIRUS HAVCR2, SLC10A1, HDGF CD44 614/4885GAA 1708/4885CYP3A4 876/4885
US-20240023549-A1 FUNGICIDAL ARYL AMIDINES CYP1A1, CYP1A2, CYP1B1 CD44 4844/4885GAA 512/4885CYP3A4 27/4885
US-20120114600-A1 NOVEL INHIBITORS OF HEPATITIS C VIRUS HAVCR2, SLC10A1, ZC3HAV1 CD44 1537/4885GAA 796/4885CYP3A4 375/4885

“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.