SCHEMBL5889304

SCHEMBL5889304

CCCCOC(=O)C1CC(c2ccccc2)NC1=O

nearest known ligand 0.49

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
PPARG P37231 3/20 0.46
L3MBTL1 Q9Y468 3/20 0.46
KDM4E B2RXH2 1/20 0.46
MAPK1 P28482 1/20 0.46
CHRM2 P08172 7/20 0.44
CHRM4 P08173 7/20 0.44
CHRM5 P08912 7/20 0.44
CHRM1 P11229 7/20 0.44
CHRM3 P20309 7/20 0.44
HPGD P15428 1/20 0.44
ATM Q13315 1/20 0.44
TSHR P16473 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
CYP1A2 P05177 1/20 0.41
CYP2D6 P10635 1/20 0.41
CYP2C19 P33261 1/20 0.41

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
SCHEMBL5889310 0.88 SLC6A3 (0.40) L3MBTL1KDM4EMAPK1CHRM2CHRM4
SCHEMBL5889311 0.81 HRH2 (0.42) L3MBTL1
SCHEMBL1902454 0.75 MEN1 (0.43) KDM4EHPGDTSHRMEN1KMT2A
SCHEMBL8178869 0.74 RAB9A (0.48) L3MBTL1KDM4ETSHRMEN1KMT2A
SCHEMBL9721781 0.73 CHRM2 (0.59) PPARGL3MBTL1KDM4EMAPK1CHRM2
SCHEMBL1196367 0.70 PPARG (0.59) PPARGL3MBTL1KDM4EMAPK1CHRM2
SCHEMBL18674041 0.69 PPARG (0.65) PPARGMAPK1CHRM2CHRM4CHRM5
SCHEMBL13082527 0.69 CHRM2 (0.55) PPARGL3MBTL1KDM4EMAPK1CHRM2
SCHEMBL9092954 0.69 TSHR (0.72) PPARGL3MBTL1KDM4EMAPK1CHRM2
SCHEMBL8733030 0.68 PPARG (0.60) PPARGL3MBTL1KDM4EMAPK1CHRM2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7122506-B2 Cyclic imines as pesticides BAYER AKTIENGESELLSCHAFT (DE) 2006-10-17 US disclosed
EP-1077938-B1 2-(2-METHYLPHENYL)-3,4-DIHYDRO-2H-PYRROL DERIVATIVES BAYER CROPSCIENCE AG (DE) 2005-04-13 EP disclosed
US-20040186287-A1 Cyclic imines as pesticides PLANT ANDREW (DE) 2004-09-23 US disclosed
EP-1080072-B1 2-(2-CHLOROPHENYL)-3,4-DIHYDRO-2H-PYRROL DERIVATIVES BAYER CROPSCIENCE AG (DE) 2004-08-04 EP disclosed
US-6770595-B2 ACTIVITY AGAINST ARTHROPODS IN AGRICULTURE AND PARASITES ENCOUNTERED IN ANIMAL HUSBANDRY BAYER AKTIENGESELLSCHAFT (DE) 2004-08-03 US disclosed
US-6599924-B1 2-hetaryl-3,4 dihydro-2H-pyrrole pesticide BAYER AKTIENGESELLSCHAFT (DE) 2003-07-29 US disclosed
EP-1306371-A1 Cyclic imines Bayer CropScience AG (DE) 2003-05-02 EP disclosed
EP-0942901-B1 CYCLIC IMINES AS PESTICIDES BAYER CROPSCIENCE AG (DE) 2003-03-05 EP disclosed
US-20020151571-A1 Cyclic imines as pesticides PLANT ANDREW (DE) 2002-10-17 US disclosed
US-6399771-B1 AGRICULTURE; VETERINARY MEDICINE BAYER AKTIENGESELLSCHAFT (DE) 2002-06-04 US disclosed
US-6274613-B1 APPLYING COMPOUNDS SUCH AS A GAMMA-ETHOXY-GAMMA-BUTYROLACTAM TO PESTS AND/OR THEIR HABITATS BAYER AKTIENGESELLSCHAFT (DE) 2001-08-14 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-20020151571-A1 Cyclic imines as pesticides DDT, CYP1A1, AR PPARG 1650/4885L3MBTL1 1894/4885KDM4E 3187/4885
US-20040186287-A1 Cyclic imines as pesticides DDT, CYP1A1, AR PPARG 1682/4885L3MBTL1 1810/4885KDM4E 3150/4885

“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.