SCHEMBL5372933

SCHEMBL5372933

CCOc1ccc(C(O)c2ccncc2OCOCC[Si](C)(C)C)cc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.42
LMNA P02545 5/20 0.37
KMT2A Q03164 3/20 0.37
CCNC P24863 4/20 0.36
CDK8 P49336 4/20 0.36
NPSR1 Q6W5P4 1/20 0.36
EGFR P00533 1/20 0.36
LCK P06239 1/20 0.36
LTA4H P09960 1/20 0.36
ALDH1A1 P00352 3/20 0.35
TP53 P04637 2/20 0.35
POLB P06746 2/20 0.35
TDP1 Q9NUW8 1/20 0.35
RAB9A P51151 4/20 0.35
KDM4E B2RXH2 3/20 0.35
SMN1; SMN2 Q16637 3/20 0.35
NPC1 O15118 3/20 0.34
MEN1 O00255 1/20 0.34
CYP1A2 P05177 1/20 0.34
CYP3A4 P08684 1/20 0.34

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
SCHEMBL4859922 0.90 IDO1 (0.33) L3MBTL1LMNAKMT2ACCNCCDK8
SCHEMBL2579273 0.85 DHODH (0.32) LTA4H
SCHEMBL4698645 0.78 CA12 (0.42) LMNAKMT2ANPSR1ALDH1A1RAB9A
SCHEMBL5388162 0.75 L3MBTL1 (0.51) L3MBTL1LMNAKMT2ACCNCCDK8
SCHEMBL4701131 0.71 ALOX5AP (0.42) MAPT
SCHEMBL4705428 0.71 ALOX5AP (0.35) MAPT
SCHEMBL4790874 0.68 ALOX5AP (0.40) L3MBTL1KMT2AALDH1A1TDP1KDM4E
SCHEMBL16012024 0.68 ALOX5AP (0.35) RAB9ASMN1; SMN2NPC1MAPT
SCHEMBL4857523 0.68 ALDH1A1 (0.36) LMNAKMT2AALDH1A1SMN1; SMN2CYP1A2
SCHEMBL9114461 0.68 NQO1 (0.64) L3MBTL1LMNAKMT2ALTA4HALDH1A1

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-7271153-B2 Treating diseases associated with hyperglycemia such as diabetes; SGLT2 (sodium/glucose cotransporter 2) inhibitor; 3-(4-Ethylbenzyl)-2-(beta-D-glucopyranosyloxy)-4,6-dimethyl-pyridine for example KISSEI PHARMACEUTICAL CO., LTD. (JP) 2007-09-18 US disclosed
US-20050049203-A1 Nitrogenous heterocyclic derivative, medicinal composition containing the same, medical use thereof, and intermediate therefor KISSEI PHARMACEUTICAL CO., LTD. (JP) 2005-03-03 US disclosed
EP-1405859-A1 NITROGENOUS HETEROCYCLIC DERIVATIVE, MEDICINAL COMPOSITION CONTAINING THE SAME, MEDICINAL USE THEREOF AND INTERMEDIATE THEREFOR Kissei Pharmaceutical Co., Ltd. (JP) 2004-04-07 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-20050049203-A1 Nitrogenous heterocyclic derivative, medicinal composition containing the same, medical use thereof, and intermediate therefor GPR119, NPR3, SLC5A2 L3MBTL1 3479/4885LMNA 2564/4885KMT2A 3588/4885

“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.