SCHEMBL4331809

SCHEMBL4331809

CCOC(=O)C(OC(C)C)C(O)c1cccc(OCc2ccccc2)c1

nearest known ligand 0.51

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.51
L3MBTL1 Q9Y468 1/20 0.51
KMT2A Q03164 2/20 0.50
SMN1; SMN2 Q16637 1/20 0.50
ALOX5 P09917 2/20 0.49
MEN1 O00255 1/20 0.49
MAOB P27338 2/20 0.46
NR4A2 P43354 1/20 0.45
BCHE P06276 1/20 0.44
PTGES O14684 1/20 0.43
LTB4R Q15722 1/20 0.42
LTB4R2 Q9NPC1 1/20 0.42
FFAR1 O14842 1/20 0.42
ACACB O00763 1/20 0.42

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
SCHEMBL5379536 0.90 KMT2A (0.53) LMNAL3MBTL1KMT2ASMN1; SMN2ALOX5
SCHEMBL4338001 0.83 LMNA (0.46) LMNAL3MBTL1KMT2ASMN1; SMN2ALOX5
SCHEMBL3370422 0.82 MRGPRX4 (0.49) LMNAL3MBTL1SMN1; SMN2FFAR1
SCHEMBL5360486 0.79 KMT2A (0.54) L3MBTL1KMT2ASMN1; SMN2ALOX5MEN1
SCHEMBL3485036 0.79 KMT2A (0.56) LMNAL3MBTL1KMT2ASMN1; SMN2ALOX5
SCHEMBL20604383 0.78 KMT2A (0.62) LMNAKMT2ASMN1; SMN2ALOX5MEN1
SCHEMBL20604382 0.78 KMT2A (0.62) LMNAKMT2ASMN1; SMN2ALOX5MEN1
SCHEMBL5358921 0.78 LMNA (0.60) LMNAL3MBTL1SMN1; SMN2ALOX5MAOB
SCHEMBL16797634 0.78 KMT2A (0.55) LMNAL3MBTL1KMT2ASMN1; SMN2ALOX5
SCHEMBL5772077 0.78 KMT2A (0.62) LMNAKMT2ASMN1; SMN2ALOX5MEN1

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-7544835-B2 Carboxylic acid derivative and salt thereof EISAI R&D MANAGEMENT CO., LTD. (JP) 2009-06-09 US disclosed
US-20040102634-A1 Carboxylic acid derivative and salt thereof EISAI R&D MANAGEMENT CO., LTD. (JP) 2004-05-27 US disclosed
EP-1380562-A1 CARBOXYLIC ACID DERIVATIVE AND SALT THEREOF Eisai Co., Ltd. (JP) 2004-01-14 EP 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-20040102634-A1 Carboxylic acid derivative and salt thereof GPR119, IRS1, SLC5A1 LMNA 3790/4885L3MBTL1 3856/4885KMT2A 2774/4885

“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.