SCHEMBL3799331

SCHEMBL3799331

CCNCCN(CCN(CCN(CC(=O)O)CC(=O)O)CC(=O)O)CC(=O)O

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 3/20 0.60
BLM P54132 2/20 0.60
PMP22 Q01453 2/20 0.60
ALOX15 P16050 2/20 0.60
TSHR P16473 2/20 0.60
CYP2C19 P33261 2/20 0.60
KDM4E B2RXH2 1/20 0.60
LMNA P02545 1/20 0.60
CHRM2 P08172 1/20 0.60
ADRA2A P08913 1/20 0.60
DRD1 P21728 1/20 0.60
SLC6A2 P23975 1/20 0.60
SLC6A4 P31645 1/20 0.60
ADRA1A P35348 1/20 0.60
DRD3 P35462 1/20 0.60
SLC6A3 Q01959 1/20 0.60
HRH3 Q9Y5N1 1/20 0.60
EYA2 O00167 1/20 0.56
APP P05067 1/20 0.56
ACE P12821 1/20 0.56

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
SCHEMBL18793625 0.96 TDP1 (0.54) TDP1BLMPMP22ALOX15TSHR
SCHEMBL30034529 0.92 LMNA (0.50) TDP1BLMPMP22ALOX15TSHR
SCHEMBL2445778 0.91 TDP1 (0.48) TDP1BLMPMP22ALOX15TSHR
SCHEMBL7779893 0.88 TDP1 (0.44) TDP1BLMPMP22ALOX15TSHR
Edetic Acid SCHEMBL27909430 0.87 TDP1 (0.67) TDP1BLMPMP22ALOX15TSHR
SCHEMBL26231257 0.84 LMNA (0.41) TDP1BLMPMP22ALOX15TSHR
SCHEMBL8244141 0.83 TDP1 (0.65) TDP1BLMPMP22ALOX15TSHR
SCHEMBL16631802 0.82 TDP1 (0.54) TDP1BLMPMP22ALOX15TSHR
SCHEMBL700291 0.82 TDP1 (0.62) TDP1BLMPMP22ALOX15TSHR
SCHEMBL700015 0.79 KDM4E (0.48) TDP1BLMPMP22ALOX15TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20160279270-A1 Fluorescent magnetic nanoprobes, methods of making, and methods of use UNIV LELAND STANFORD JUNIOR (US) 2016-09-29 US disclosed
US-9402926-B2 Fluorescent magnetic nanoprobes, methods of making, and methods of use THE BOARD OF TRUSTEES OF THE LELAND STANFORD JUNIOR UNIVERSITY (US) 2016-08-02 US disclosed
US-20140227190-A1 Fluorescent magnetic nanoprobes, methods of making, and methods of use NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2014-08-14 US disclosed
US-8722017-B2 Fluorescent magnetic nanoprobes, methods of making, and methods of use THE BOARD OF TRUSTEES OF THE LELAND STANFORD JUNIOR UNIVERSITY (US) 2014-05-13 US disclosed
US-20100008862-A1 Fluorescent magnetic nanoprobes, methods of making, and methods of use NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2010-01-14 US disclosed