SCHEMBL6485757

SCHEMBL6485757

CCCC(C)(NC(=O)C(Cl)c1ccccc1OC)C(=O)O

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPSR1 Q6W5P4 2/20 0.43
POLB P06746 2/20 0.43
HTT P42858 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
ALDH1A1 P00352 5/20 0.40
TSHR P16473 4/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
CYP1A2 P05177 2/20 0.38
CYP3A4 P08684 2/20 0.38
GAA P10253 1/20 0.38
CYP2C9 P11712 1/20 0.38
CYP2C19 P33261 1/20 0.38
KDM4E B2RXH2 2/20 0.37
MEN1 O00255 3/20 0.37
KMT2A Q03164 3/20 0.37
HPGD P15428 2/20 0.37
TP53 P04637 1/20 0.36
GLA P06280 1/20 0.36
HTR1A P08908 1/20 0.36
CYP2D6 P10635 1/20 0.36

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
SCHEMBL6481350 0.90 ALDH1A1 (0.40) NPSR1POLBHTTL3MBTL1ALDH1A1
SCHEMBL6475277 0.81 POLB (0.46) NPSR1POLBHTTL3MBTL1ALDH1A1
SCHEMBL6475295 0.81 POLB (0.46) NPSR1POLBHTTL3MBTL1ALDH1A1
SCHEMBL6483622 0.80 NPSR1 (0.41) NPSR1L3MBTL1ALDH1A1KMT2A
SCHEMBL6474679 0.79 L3MBTL1 (0.42) NPSR1POLBHTTL3MBTL1ALDH1A1
SCHEMBL27401982 0.78 ALDH1A1 (0.42) HTTL3MBTL1ALDH1A1CYP1A2CYP3A4
SCHEMBL27405551 0.76 KDM4E (0.39) NPSR1L3MBTL1ALDH1A1TSHRKDM4E
SCHEMBL6481425 0.76 ALDH1A1 (0.43) NPSR1POLBHTTL3MBTL1ALDH1A1
SCHEMBL6475066 0.75 POLB (0.43) NPSR1POLBHTTL3MBTL1ALDH1A1
SCHEMBL8654208 0.75 LMNA (0.37) POLBALDH1A1SMN1; SMN2GAAMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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 NPSR1 828/4885POLB 4505/4885HTT 1990/4885

“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.