SCHEMBL80486

SCHEMBL80486

C[C@@H](Nc1c(-c2c(F)cc(F)cc2F)c(Cl)nc2ncnn12)C(C)(C)C

nearest known ligand 0.35

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 2/20 0.35
KMT2A Q03164 2/20 0.34
GAA P10253 2/20 0.34
MEN1 O00255 1/20 0.34
ALDH1A1 P00352 4/20 0.34
TSHR P16473 2/20 0.34
POLB P06746 1/20 0.34
ALOX15 P16050 1/20 0.31
KDM4E B2RXH2 1/20 0.31
LMNA P02545 1/20 0.31
RAB9A P51151 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
CRHR1 P34998 1/20 0.31

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
SCHEMBL977522 1.00 MAPK1 (0.35) MAPK1KMT2AGAAMEN1ALDH1A1
SCHEMBL3117730 1.00 MAPK1 (0.35) MAPK1KMT2AGAAMEN1ALDH1A1
SCHEMBL25616307 0.92 ALDH1A1 (0.35) MAPK1KMT2AGAAMEN1ALDH1A1
SCHEMBL23925472 0.91 ALDH1A1 (0.33) MAPK1KMT2AGAAMEN1ALDH1A1
SCHEMBL23925473 0.91 ALDH1A1 (0.33) MAPK1KMT2AGAAMEN1ALDH1A1
SCHEMBL343322 0.91 MAPK1 (0.35) MAPK1KMT2AGAAMEN1ALDH1A1
SCHEMBL4818612 0.91 MAPK1 (0.35) MAPK1KMT2AGAAMEN1ALDH1A1
SCHEMBL976390 0.91 MAPK1 (0.35) MAPK1KMT2AGAAMEN1ALDH1A1
SCHEMBL4816443 0.89 CRHR1 (0.38) MAPK1KMT2AGAAMEN1ALDH1A1
SCHEMBL29783520 0.89 MAPK1 (0.34) MAPK1KMT2AGAAMEN1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090149455-A1 Use of Triazolopyrimidines for Controlling Plant Diseases on Legumes BAYER CROPSCIENCE AG (DE) 2009-06-11 US claimed
US-20090117200-A1 Fungicide Composition Comprising a Phosphorous Acid Derivative, a Mandelamide Type Compound and a Further Fungicide Compound BAYER SAS (FR) 2009-05-07 US claimed
US-20090018176-A1 FUNGICIDE COMPOSITION COMPRISING AN ARYLAMIDINE DERIVATIVE AND TWO KNOWN FUNGICIDE COMPOUNDS BAYER CROPSCIENCE AG (DE) 2009-01-15 US claimed
EP-1931200-A1 FUNGICIDE COMPOSITION COMPRISING AN ARYLAMIDINE DERIVATIVE AND TWO KNOWN FUNGICIDE COMPOUNDS Bayer CropScience AG (DE) 2008-06-18 EP claimed
EP-1898709-A1 FUNGICIDE COMPOSITION COMPRISING A PHOSPHOROUS ACID DERIVATIVE, A MANDELAMIDE TYPE COMPOUND AND A FURTHER FUNGICIDE COMPOUND Bayer CropScience S.A. (FR) 2008-03-19 EP claimed
EP-1713336-B1 FUNGICIDAL COMPOSITION COMPRISING A PYRIDYLETHYLBENZAMIDE DERIVATIVE AND A COMPOUND CAPABLE OF INHIBITING MITOSIS AND CELL DIVISION BAYER CROPSCIENCE SA (FR) 2007-07-04 EP claimed
WO-2007031507-A1 FUNGICIDE COMPOSITION COMPRISING AN ARYLAMIDINE DERIVATIVE AND TWO KNOWN FUNGICIDE COMPOUNDS BAYER CROPSCIENCE AG (DE) 2007-03-22 WO claimed
WO-2006136551-A1 FUNGICIDE COMPOSITION COMPRISING A PHOSPHOROUS ACID DERIVATIVE, A MANDELAMIDE TYPE COMPOUND AND A FURTHER FUNGICIDE COMPOUND BAYER CROPSCIENCE SA (FR) 2006-12-28 WO claimed
US-20250388630-A1 FUSION PROTEINS, RECOMBINANT BACTERIA, AND METHODS FOR USING RECOMBINANT BACTERIA SPOGEN BIOTECH INC (US) 2025-12-25 US disclosed
US-12391729-B2 Fusion proteins, recombinant bacteria, and methods for using recombinant bacteria SPOGEN BIOTECH INC. (US) 2025-08-19 US disclosed
US-20240199709-A1 FUSION PROTEINS, RECOMBINANT BACTERIA, AND METHODS FOR USING RECOMBINANT BACTERIA SPOGEN BIOTECH INC (US) 2024-06-20 US disclosed
US-11905315-B2 Fusion proteins, recombinant bacteria, and methods for using recombinant bacteria SPOGEN BIOTECH INC. (US) 2024-02-20 US disclosed
WO-2022268520-A1 USE OF SUBSTITUTED PYRROLIDINONES OR THEIR SALTS FOR INCREASING STRESS TOLERANCE OF PLANTS BAYER AKTIENGESELLSCHAFT (DE) 2022-12-29 WO disclosed
US-20220227772-A1 DEUTERATED TRIAZOLOPYRIMIDINES THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2022-07-21 US disclosed
WO-2006000313-A1 N-PHENYLPYRAZOLE DERIVATIVES AS PESTICIDES MERIAL LTD. (US) 2006-01-05 WO disclosed
WO-2006000312-A1 PESTICIDAL N-PHENYLPYRAZOLE DERIVATIVES MERIAL LTD. (US) 2006-01-05 WO disclosed
WO-2006000311-A1 1-ARYLPYRAZOLE DERIVATIVES PESTICIDAL AGENTS MERIAL LTD. (US) 2006-01-05 WO disclosed
WO-2006000315-A1 PESTICIDAL AGENTS ON THE BASIS OF 1- ARYL- AMINOPYRROL MERIAL LTD. (US) 2006-01-05 WO disclosed
US-6855718-B2 7-(r)-aminotriazolopyrimidines, the production thereof and use of the same for combatting phytopathogenic fungi BASF AKTIENGESELLSCHAFT (DE) 2005-02-15 US disclosed
US-20040110771-A1 7-(r)-aminotriazolopyrimidines, the production thereof and use of the same for combatting phytopathogenic fungi BASF AKTIENGESELLSCHAFT (DE) 2004-06-10 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 (6 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-20090117200-A1 Fungicide Composition Comprising a Phosphorous Acid Derivative, a Mandelamide Type Compound and a Further Fungicide Compound PPA1, PPME1, MTAP MAPK1 621/4885KMT2A 1492/4885GAA 436/4885
US-20220227772-A1 DEUTERATED TRIAZOLOPYRIMIDINES MAPT, TUBB6, MAP2 MAPK1 1158/4885KMT2A 2175/4885GAA 2191/4885
US-20090018176-A1 FUNGICIDE COMPOSITION COMPRISING AN ARYLAMIDINE DERIVATIVE AND TWO KNOWN FUNGICIDE COMPOUNDS NAT1, DDT, CNPY2 MAPK1 3189/4885KMT2A 982/4885GAA 467/4885
US-20040110771-A1 7-(r)-aminotriazolopyrimidines, the production thereof and use of the same for combatting phytopathogenic fungi CBR1, CBR3, DPM1 MAPK1 656/4885KMT2A 856/4885GAA 4022/4885
US-20250388630-A1 FUSION PROTEINS, RECOMBINANT BACTERIA, AND METHODS FOR USING RECOMBINANT BACTERIA MAX, SEC62, GHITM MAPK1 2712/4885KMT2A 4694/4885GAA 2713/4885
US-20090149455-A1 Use of Triazolopyrimidines for Controlling Plant Diseases on Legumes TYMP, CCNT2, PNPO MAPK1 1694/4885KMT2A 1970/4885GAA 638/4885

“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.