SCHEMBL821111

SCHEMBL821111

O=C1CNC(=O)C1c1ccccc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.43
LMNA P02545 2/20 0.43
CYP1A2 P05177 2/20 0.43
TP53 P04637 1/20 0.43
CYP3A4 P08684 1/20 0.43
MAPK1 P28482 1/20 0.43
HTR2B P41595 1/20 0.43
DDB1 Q16531 1/20 0.39
CRBN Q96SW2 1/20 0.39
SLC6A3 Q01959 3/20 0.38
CA2 P00918 2/20 0.37
GAA P10253 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
KDM4E B2RXH2 1/20 0.36
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
MAOA P21397 2/20 0.35
MAOB P27338 2/20 0.35
CYP2C19 P33261 2/20 0.35
KDM1A O60341 1/20 0.35

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
SCHEMBL576378 0.73 SLC18A3 (0.45) MAPTLMNACYP1A2TP53CYP3A4
SCHEMBL576980 0.73 SLC18A3 (0.45) MAPTLMNACYP1A2TP53CYP3A4
SCHEMBL576724 0.73 SLC18A3 (0.45) MAPTLMNACYP1A2TP53CYP3A4
SCHEMBL5315718 0.72 CYP1A2 (0.54) MAPTLMNACYP1A2TP53CYP3A4
SCHEMBL10532107 0.71 RAB9A (0.54) MAPTCYP3A4DDB1CRBNCA2
SCHEMBL5666189 0.71 LMNA (0.39) MAPTLMNACYP1A2TP53CYP3A4
SCHEMBL577173 0.71 SLC18A3 (0.42) MAPTLMNACYP1A2TP53CYP3A4
SCHEMBL7883065 0.70 MAPT (0.52) MAPTLMNACYP1A2TP53CYP3A4
SCHEMBL576866 0.69 SLC18A3 (0.41) MAPTLMNACYP1A2TP53CYP3A4
SCHEMBL2396347 0.69 ALDH1A1 (0.42) MAPTTP53MAPK1GAASMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20180282275-A1 New alkynyl-substituted 3-phenylpyrrolidine-2,4-diones and use thereof as herbicides BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) 2018-10-04 US claimed
WO-2017060204-A1 NEW ALKYNYL-SUBSTITUTED 3-PHENYLPYRROLIDINE-2,4-DIONES AND USE THEREOF AS HERBICIDES BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) 2017-04-13 WO claimed
US-8334300-B2 C2-phenyl-substituted cyclic ketonols BAYER AKTIENGESELLSHAFT (DE) 2012-12-18 US claimed
US-20110183849-A1 C2-PHENYL-SUBSTITUTED CYCLIC KETONOLS BAYER AKTIENGESELLSCHAFT (DE) 2011-07-28 US claimed
EP-1280770-B1 C 2? PHENYL-SUBSTITUTED CYCLIC KETO-ENOLS USED AS PESTICIDES AND HERBICIDES BAYER AG (DE) 2010-06-23 EP claimed
US-20030216260-A1 C2-phenyl-substituted cyclic keto-enols used as pesticides and herbicides BAYER INTELLECTUAL PROPERTY GMBH (DE) 2003-11-20 US claimed
EP-1280770-A1 C 2? PHENYL-SUBSTITUTED CYCLIC KETO-ENOLS USED AS PESTICIDES AND HERBICIDES Bayer Aktiengesellschaft (DE) 2003-02-05 EP claimed
WO-2001074770-A1 C2 PHENYL-SUBSTITUTED CYCLIC KETO-ENOLS USED AS PESTICIDES AND HERBICIDES BAYER CROPSCIENCE AG (DE) 2001-10-11 WO claimed
US-20230059463-A1 3-(2-BROMO-4-ALKYNYL-6-ALKOXYPHENYL)-SUBSTITUTED 5-SPIROCYCLOHEXYL-3-PYRROLIN-2-ONES AND THEIR USE AS HERBICIDES BAYER AKTIENGESELLSCHAFT (DE) 2023-02-23 US disclosed
US-20220386606-A1 SPECIFICALLY SUBSTITUTED 3-PHENYL-5-SPIROCYCLOPENTYL-3-PYRROLIN-2-ONES AND THEIR USE AS HERBICIDES BAYER AKTIENGESELLSCHAFT (DE) 2022-12-08 US disclosed
US-20220151230-A1 SPECIFICALLY SUBSTITUTED 3-(2-HALOGEN-6-ALKYL-4-PROPINYLPHENYL)-3-PYRROLIN-2-ONES AND TO THE USE THEREOF AS HERBICIDES BAYER AKTIENGESELLSCHAFT (DE) 2022-05-19 US disclosed
US-20220151230-A1 SPECIFICALLY SUBSTITUTED 3-(2-HALOGEN-6-ALKYL-4-PROPINYLPHENYL)-3-PYRROLIN-2-ONES AND TO THE USE THEREOF AS HERBICIDES BAYER AKTIENGESELLSCHAFT (DE) 2022-05-19 US disclosed
CN-108349888-B Novel alkynyl-substituted 3-phenylpyrrolidine-2, 4-diones and their use as herbicides 拜耳作物科学股份公司 2022-03-25 CN disclosed
CN-108349888-B Novel alkynyl-substituted 3-phenylpyrrolidine-2, 4-diones and their use as herbicides 拜耳作物科学股份公司 2022-03-25 CN disclosed
WO-1999043649-A1 ARYLPHENYL-SUBSTITUTED CYCLIC KETO-ENOLS BAYER AKTIENGESELLSCHAFT (DE) 1999-09-02 WO disclosed
EP-0918775-A1 PHENYL-SUBSTITUTED CYCLIC KETOENOL BAYER AG (DE) 1999-06-02 EP disclosed
WO-1999016748-A1 UTILIZING SPIROCYCLIC PHENYL KETO-ENOLS AS PESTICIDES AND HERBICIDES BAYER AKTIENGESELLSCHAFT (DE) 1999-04-08 WO disclosed
WO-1998006721-A1 PHENYL-SUBSTITUTED CYCLIC KETOENOL BAYER AKTIENGESELLSCHAFT (DE) 1998-02-19 WO disclosed
EP-0809629-A1 2-PHENYL-SUBSTITUTED HETEROCYCLIC 1,3-KETONOLS AS HERBICIDES AND PESTICIDES BAYER AG (DE) 1997-12-03 EP disclosed
WO-1996025395-A1 2-PHENYL-SUBSTITUTED HETEROCYCLIC 1,3-KETONOLS AS HERBICIDES AND PESTICIDES BAYER AKTIENGESELLSCHAFT (DE) 1996-08-22 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 (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-20220386606-A1 SPECIFICALLY SUBSTITUTED 3-PHENYL-5-SPIROCYCLOPENTYL-3-PYRROLIN-2-ONES AND THEIR USE AS HERBICIDES DDT, HPD, AGPS MAPT 3960/4885LMNA 4352/4885CYP1A2 145/4885
US-20030216260-A1 C2-phenyl-substituted cyclic keto-enols used as pesticides and herbicides PDHX, AKR1C3, AKR1A1 MAPT 4082/4885LMNA 2316/4885CYP1A2 81/4885
US-20180282275-A1 New alkynyl-substituted 3-phenylpyrrolidine-2,4-diones and use thereof as herbicides CBR3, HDHD5, HPD MAPT 4443/4885LMNA 2562/4885CYP1A2 95/4885
US-20110183849-A1 C2-PHENYL-SUBSTITUTED CYCLIC KETONOLS AKR1C3, PDHX, AKR1C2 MAPT 3712/4885LMNA 1007/4885CYP1A2 88/4885
US-20220151230-A1 SPECIFICALLY SUBSTITUTED 3-(2-HALOGEN-6-ALKYL-4-PROPINYLPHENYL)-3-PYRROLIN-2-ONES AND TO THE USE THEREOF AS HERBICIDES DDT, HPD, PFAS MAPT 4431/4885LMNA 4286/4885CYP1A2 41/4885
US-20230059463-A1 3-(2-BROMO-4-ALKYNYL-6-ALKOXYPHENYL)-SUBSTITUTED 5-SPIROCYCLOHEXYL-3-PYRROLIN-2-ONES AND THEIR USE AS HERBICIDES DDT, BROX, CBR3 MAPT 4139/4885LMNA 3871/4885CYP1A2 86/4885

“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.