SCHEMBL4337094

SCHEMBL4337094

COc1cccc(NC(=O)OCCc2cccc(CC(C(=O)O)C(=O)O)c2)c1

nearest known ligand 0.56

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MGLL Q99685 1/20 0.54
LMNA P02545 2/20 0.53
SMN1; SMN2 Q16637 2/20 0.53
THRB P10828 2/20 0.53
RECQL P46063 1/20 0.53
RAB9A P51151 5/20 0.53
USP2 O75604 1/20 0.52
MTNR1B P49286 1/20 0.52
KMT2A Q03164 3/20 0.51
TP53 P04637 2/20 0.49
NPC1 O15118 4/20 0.48
MEN1 O00255 2/20 0.48
MAPT P10636 1/20 0.48
MITF O75030 1/20 0.47
TSHR P16473 1/20 0.47
KDM4E B2RXH2 1/20 0.47
CASR P41180 1/20 0.47
NPSR1 Q6W5P4 1/20 0.46

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
SCHEMBL13810371 0.93 MGLL (0.51) MGLLLMNASMN1; SMN2THRBRECQL
SCHEMBL4334130 0.90 LMNA (0.56) MGLLLMNASMN1; SMN2RECQLRAB9A
SCHEMBL4333262 0.89 USP2 (0.54) MGLLLMNASMN1; SMN2THRBRECQL
SCHEMBL4339388 0.87 MGLL (0.62) MGLLLMNASMN1; SMN2RECQLRAB9A
SCHEMBL4339140 0.86 MTNR1B (0.47) MGLLLMNASMN1; SMN2THRBRECQL
SCHEMBL4341213 0.84 MEN1 (0.60) MGLLLMNASMN1; SMN2THRBRECQL
SCHEMBL13810359 0.84 MGLL (0.58) MGLLLMNASMN1; SMN2RECQLRAB9A
SCHEMBL13810370 0.83 LMNA (0.53) MGLLLMNASMN1; SMN2RAB9AMTNR1B
SCHEMBL4328095 0.83 MGLL (0.51) MGLLLMNASMN1; SMN2RECQLRAB9A
SCHEMBL13810339 0.82 RAB9A (0.54) MGLLLMNASMN1; SMN2THRBRECQL

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 MGLL 3539/4885LMNA 3790/4885SMN1; SMN2 3054/4885

“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.