SCHEMBL1361571

SCHEMBL1361571

CCCCCCCC/C=C\CCCCCCCCN1CC(C(=O)OCCOCCOCCOC(=O)C2CC(=O)N(CCCCCCCC/C=C\CCCCCCCC)C2)CC1=O

nearest known ligand 0.42

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.42
ALDH1A1 P00352 1/20 0.42
CYP2C19 P33261 2/20 0.40
KMT2A Q03164 2/20 0.40
MEN1 O00255 1/20 0.40
CYP1A2 P05177 1/20 0.40
CYP3A4 P08684 1/20 0.40
CYP2D6 P10635 1/20 0.40
CYP2C9 P11712 1/20 0.40
RECQL P46063 1/20 0.40
FAAH O00519 3/20 0.39
MGLL Q99685 2/20 0.39
EPHX2 P34913 1/20 0.38
ATM Q13315 1/20 0.37
BRD4 O60885 1/20 0.36
GBA1 P04062 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
SCHEMBL8154312 0.88 L3MBTL1 (0.43) L3MBTL1ALDH1A1CYP2C19KMT2AMEN1
SCHEMBL3825328 0.87 MEN1 (0.47) L3MBTL1ALDH1A1CYP2C19KMT2AMEN1
SCHEMBL3825321 0.87 MEN1 (0.47) L3MBTL1ALDH1A1CYP2C19KMT2AMEN1
SCHEMBL15042003 0.86 ALDH1A1 (0.49) L3MBTL1ALDH1A1CYP2C19KMT2AMEN1
SCHEMBL15042050 0.86 L3MBTL1 (0.49) L3MBTL1ALDH1A1CYP2C19KMT2AMEN1
SCHEMBL15042043 0.86 L3MBTL1 (0.49) L3MBTL1ALDH1A1CYP2C19KMT2AMEN1
SCHEMBL15042105 0.86 ALDH1A1 (0.49) L3MBTL1ALDH1A1CYP2C19KMT2AMEN1
SCHEMBL12668082 0.86 L3MBTL1 (0.49) L3MBTL1ALDH1A1CYP2C19KMT2AMEN1
SCHEMBL15042037 0.86 L3MBTL1 (0.49) L3MBTL1ALDH1A1CYP2C19KMT2AMEN1
SCHEMBL15042108 0.86 ALDH1A1 (0.49) L3MBTL1ALDH1A1CYP2C19KMT2AMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8067651-B2 1-alkyl-5-oxopyrrolidine-3-carboxylic esters with improved biodegradability CLARIANT FINANCE (BVI) LIMITED (VG) 2011-11-29 US disclosed
US-20090043146-A1 1-Alkyl-5-oxopyrrolidine-3-carboxylic esters with improved biodegradability CLARIANT INTERNATIONAL LTD. 2009-02-12 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-20090043146-A1 1-Alkyl-5-oxopyrrolidine-3-carboxylic esters with improved biodegradability OXER1, CYP1A1, CHRM1 L3MBTL1 3078/4885ALDH1A1 736/4885CYP2C19 116/4885

“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.