SCHEMBL2175972

SCHEMBL2175972

CCC(=O)OCC(=O)c1ccccc1

nearest known ligand 0.66

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 5/20 0.57
RAB9A P51151 4/20 0.57
KMT2A Q03164 5/20 0.57
MAPT P10636 4/20 0.57
MEN1 O00255 4/20 0.57
HPGD P15428 2/20 0.57
L3MBTL1 Q9Y468 2/20 0.57
CYP1A2 P05177 2/20 0.50
CYP2C19 P33261 2/20 0.50
CYP3A4 P08684 1/20 0.50
TSHR P16473 1/20 0.50
LMNA P02545 1/20 0.50
ESR1 P03372 1/20 0.50
ESR2 Q92731 1/20 0.50
ELANE P08246 1/20 0.50
GAA P10253 1/20 0.49
TP53 P04637 1/20 0.49
ALDH1A1 P00352 1/20 0.49
CYP2C9 P11712 1/20 0.49

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
SCHEMBL11461528 0.87 HTT (0.57) NPC1RAB9AKMT2AMAPTMEN1
SCHEMBL7611620 0.85 MAPT (0.62) NPC1RAB9AKMT2AMAPTMEN1
SCHEMBL9547929 0.84 KMT2A (0.60) NPC1RAB9AKMT2AMAPTMEN1
SCHEMBL9200565 0.83 ALDH1A1 (0.60) NPC1RAB9AKMT2AMAPTL3MBTL1
SCHEMBL7946523 0.82 MAPT (0.58) NPC1RAB9AKMT2AMAPTMEN1
SCHEMBL12231836 0.82 USP2 (0.55) NPC1RAB9AKMT2AMAPTMEN1
SCHEMBL20055247 0.81 HPGD (0.58) NPC1RAB9AKMT2AMAPTMEN1
SCHEMBL31468786 0.81 NPC1 (0.54) NPC1RAB9AKMT2AMAPTMEN1
SCHEMBL28689137 0.81 L3MBTL1 (0.50) NPC1KMT2AMAPTMEN1HPGD
SCHEMBL13275229 0.81 LMNA (0.53) NPC1RAB9AKMT2AHPGDL3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-107876092-B Application of titanium catalyst with cyclic structure as reaction catalyst for synthesizing benzyl carbonate or diphenyl carbonate by ester exchange 华东理工大学 2023-01-10 CN claimed
US-20200163916-A1 PROBENECID FOR USE IN TREATING EPILEPTIC DISEASES, DISORDERS OR CONDITIONS PARIS SCIENCES ET LETTRES - QUARTIER LATIN (FR) 2020-05-28 US disclosed
CN-108633282-A Method for preparing crosslinked pressure sensitive adhesives using light emitting diode crosslinking 3M创新有限公司 2018-10-09 CN disclosed
US-9328335-B2 Method to produce acetyldiacylglycerols (ac-TAGs) by expression of an acetyltransferase gene isolated from Euonymus alatus (burning bush) BOARD OF TRUSTEES OF MICHIGAN STATE UNIVERSITY (US) 2016-05-03 US disclosed
US-20130116462-A1 METHOD TO PRODUCE ACETYLDIACYLGLYCEROLS (AC-TAGS) BY EXPRESSION OF AN ACETYLTRANSFERASE GENE ISOLATED FROM EUONYMUS ALATUS (BURNING BUSH) BOARD OF TRUSTEES OF MICHIGAN STATE UNIVERSITY (US) 2013-05-09 US disclosed
WO-2011082253-A2 A METHOD TO PRODUCE ACETYLDIACYLGLYCEROLS (AC-TAGS) BY EXPRESSION OFAN ACETYLTRANSFERASE GENE ISOLATED FROM EUONYMUS ALATUS (BURNING BUSH) BOARD OF TRUSTEES OF MICHIGAN STATE UNIVERSITY (US) 2011-07-07 WO disclosed
US-7429473-B2 Diacylglycerol acyltransferase genes, proteins, and uses thereof MICHIGAN STATE UNIVERSITY (US) 2008-09-30 US disclosed
CN-100404636-C Single-layer coated adhesive tape 3M INNOVATIVE PROPERTIES CO (US) 2008-07-23 CN disclosed
US-20070028329-A1 Diacylglycerol acyltransferase genes, proteins, and uses thereof BOARD OF TRUSTEES OPERATING MICHIGAN STATE UNIVERSITY 2007-02-01 US disclosed
CN-1882668-A Single-layer coated adhesive tape 3M INNOVATIVE PROPERTIES CO (US) 2006-12-20 CN disclosed
US-7122367-B2 Diacylglycerol acyltransferase genes, proteins, and uses thereof BOARD OF TRUSTEES OPERATING MICHIGAN STATE UNIVERSITY (US) 2006-10-17 US disclosed
US-20050130284-A1 Diacylglycerol acyltransferase genes, proteins, and uses thereof BOARD OF TRUSTEES OPERATING MICHIGAN STATE UNIVERSITY, THE 2005-06-16 US disclosed
EP-1484392-A1 Diacylglycerol acyltransferase genes, proteins and uses thereof Board of Trustees Operating Michigan State University (US) 2004-12-08 EP disclosed
US-4054719-A ACRYLIC ESTER, TERTIARY AMINE AMERICAN CYANAMID COMPANY (US) 1977-10-18 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-20200163916-A1 PROBENECID FOR USE IN TREATING EPILEPTIC DISEASES, DISORDERS OR CONDITIONS NLN, CLN6, SLC1A2 NPC1 216/4885RAB9A 1266/4885KMT2A 2257/4885

“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.