SCHEMBL7563709

SCHEMBL7563709

CC(C)C[C@H](NCO)C(=O)O

nearest known ligand 0.57

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.57
MEN1 O00255 1/20 0.53
LMNA P02545 1/20 0.53
KMT2A Q03164 1/20 0.53
MAPT P10636 1/20 0.50
FOLH1 Q04609 4/20 0.47
MME P08473 4/20 0.46
LAP3 P28838 3/20 0.44
RNPEP Q9H4A4 1/20 0.43
SLC7A5 Q01650 1/20 0.43
PLA2G2A P14555 2/20 0.42
PLA2G5 P39877 2/20 0.42
GRN P28799 1/20 0.42
SORT1 Q99523 1/20 0.42
NAALAD2 Q9Y3Q0 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
SCHEMBL7563707 1.00 ALDH1A1 (0.57) ALDH1A1MEN1LMNAKMT2AMAPT
SCHEMBL24119241 0.84 ALDH1A1 (0.55) ALDH1A1MEN1LMNAKMT2AMAPT
SCHEMBL6374257 0.83 ALDH1A1 (0.53) ALDH1A1MEN1LMNAKMT2AMAPT
SCHEMBL596517 0.83 ALDH1A1 (0.59) ALDH1A1MEN1LMNAKMT2AMAPT
SCHEMBL6010360 0.82 ALDH1A1 (0.48) ALDH1A1MEN1LMNAKMT2AMAPT
SCHEMBL6010370 0.82 ALDH1A1 (0.48) ALDH1A1MEN1LMNAKMT2AMAPT
SCHEMBL7916647 0.82 ALDH1A1 (0.47) ALDH1A1MEN1LMNAKMT2AMAPT
SCHEMBL73762 0.82 MAPT (0.60) ALDH1A1MEN1LMNAKMT2AMAPT
SCHEMBL839404 0.82 ALDH1A1 (0.59) ALDH1A1MEN1LMNAKMT2AMAPT
SCHEMBL3451868 0.82 ALDH1A1 (0.59) ALDH1A1MEN1LMNAKMT2AMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0792146-A1 INACTIVATION OF PATHOGENS USING HYDROXYMETHYLAMINES HEMASURE, INC. (US) 1997-09-03 EP claimed
WO-1997002028-A1 INACTIVATION OF PATHOGENS USING HYDROXYMETHYLAMINES HEMASURE, INC. (US) 1997-01-23 WO claimed
CN-105169369-B Treat and prevent the method and pharmaceutical composition of hepatitis C infection 中美华世通生物医药科技(武汉)有限公司 2019-10-18 CN disclosed
WO-2010046713-A2 METHODS FOR PREPARING HETEROCYCLIC RINGS ISIS INNOVATION (GB) 2010-04-29 WO disclosed
EP-1229889-A1 USE OF A NONIMMUNOSUPPRESSIVE CYCLOSPORIN A DERIVATIVE FOR HAIR GROWTH LG Household & Health Care Ltd. (KR) 2002-08-14 EP disclosed
WO-2001035913-A1 USE OF A NONIMMUNOSUPPRESSIVE CYCLOSPORIN A DERIVATIVE FOR HAIR GROWTH LG HOUSEHOLD & HEALTH CARE LTD. (KR) 2001-05-25 WO disclosed
EP-0792146-A1 INACTIVATION OF PATHOGENS USING HYDROXYMETHYLAMINES HEMASURE, INC. (US) 1997-09-03 EP disclosed
WO-1997002028-A1 INACTIVATION OF PATHOGENS USING HYDROXYMETHYLAMINES HEMASURE, INC. (US) 1997-01-23 WO disclosed
EP-0606295-A1 TETRAPHENYLPORPHYN DERIVATIVES SANDOZ-ERFINDUNGEN Verwaltungsgesellschaft m.b.H. (AT) 1994-07-20 EP disclosed