SCHEMBL4433288

SCHEMBL4433288

CCC(C)C(C)(NC(=O)Cc1c(Cl)cccc1OC)C(=O)OC

nearest known ligand 0.42

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
TAS1R3 Q7RTX0 1/20 0.42
TAS1R1 Q7RTX1 1/20 0.42
LPAR1 Q92633 2/20 0.41
SMN1; SMN2 Q16637 4/20 0.41
ANO1 Q5XXA6 1/20 0.41
ALDH1A1 P00352 2/20 0.40
LMNA P02545 3/20 0.40
THRB P10828 1/20 0.40
POLB P06746 1/20 0.39
MAPK1 P28482 1/20 0.38
HPGD P15428 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.37
PLA2G2A P14555 2/20 0.37

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
SCHEMBL4435090 0.91 LPAR1 (0.41) LPAR1SMN1; SMN2ANO1ALDH1A1LMNA
SCHEMBL6473687 0.91 LPAR1 (0.42) LPAR1SMN1; SMN2ANO1ALDH1A1LMNA
SCHEMBL6481421 0.83 THRB (0.46) SMN1; SMN2ANO1ALDH1A1LMNATHRB
SCHEMBL27384190 0.81 TAS1R3 (0.43) TAS1R3TAS1R1SMN1; SMN2ALDH1A1LMNA
Bicarbonate SCHEMBL9094313 0.81 KMT2A (0.46) ALDH1A1HPGDL3MBTL1
SCHEMBL6475063 0.81 SMN1; SMN2 (0.44) SMN1; SMN2ANO1ALDH1A1LMNATHRB
SCHEMBL4428390 0.81 SMN1; SMN2 (0.41) SMN1; SMN2ANO1ALDH1A1LMNATHRB
SCHEMBL4428398 0.79 TAS1R3 (0.46) TAS1R3TAS1R1LPAR1ANO1ALDH1A1
SCHEMBL6475271 0.78 SHMT1 (0.48) SMN1; SMN2ANO1ALDH1A1LMNATHRB
SCHEMBL6990974 0.78 TAS1R3 (0.43) TAS1R3TAS1R1LPAR1SMN1; SMN2ANO1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0741700-B1 1-H-3-ARYLPYRROLIDINE-2,4-DIONE DERIVATIVES AS PEST-CONTROL AGENTS BAYER CROPSCIENCE AG (DE) 2009-10-07 EP disclosed
US-6939888-B2 1-H-3-arylpirrolidine-2,4-dione derivatives BAYER AKTIENGESELLSCHAFT (DE) 2005-09-06 US disclosed
US-20040019061-A1 1-H-3-arylpirrolidine-2,4-dione derivatives FISCHER REINER (DE) 2004-01-29 US disclosed
US-6472419-B1 1-H-3-aryl-pyrrolidine-2, 4-dione derivatives as pest-control agents BAYER AKTIENGESELLSCHAFT (DE) 2002-10-29 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 (1 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-20040019061-A1 1-H-3-arylpirrolidine-2,4-dione derivatives PRXL2A, DDT, CYP4B1 TAS1R3 1447/4885TAS1R1 1668/4885LPAR1 1124/4885

“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.