SCHEMBL1792142

SCHEMBL1792142

CC(C)C(=O)c1ccccc1.O=P

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 2/20 0.52
L3MBTL1 Q9Y468 2/20 0.52
KDM4E B2RXH2 1/20 0.52
DBH P09172 1/20 0.52
GAA P10253 1/20 0.52
RECQL P46063 1/20 0.52
PGR P06401 1/20 0.52
ADRA2A P08913 1/20 0.52
ADRA2B P18089 1/20 0.52
HTR2A P28223 1/20 0.52
HRH1 P35367 1/20 0.52
KCNH2 Q12809 1/20 0.52
LMNA P02545 4/20 0.50
CES2 O00748 3/20 0.50
CES1 P23141 3/20 0.50
SMN1; SMN2 Q16637 3/20 0.47
NPSR1 Q6W5P4 3/20 0.47
ATM Q13315 2/20 0.47
MDM2 Q00987 1/20 0.47
MAPT P10636 1/20 0.47

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
SCHEMBL28283115 0.95 TDP1 (0.56) TDP1L3MBTL1KDM4EDBHGAA
SCHEMBL163939 0.95 TDP1 (0.56) TDP1L3MBTL1KDM4EDBHGAA
Hydrochloric Acid SCHEMBL27519979 0.93 TDP1 (0.54) TDP1L3MBTL1KDM4EDBHGAA
SCHEMBL27996952 0.93 TDP1 (0.54) TDP1L3MBTL1KDM4EDBHGAA
Bromide SCHEMBL8414921 0.93 TDP1 (0.54) TDP1L3MBTL1KDM4EDBHGAA
Acetic Acid SCHEMBL28771195 0.91 TDP1 (0.52) TDP1L3MBTL1KDM4EDBHGAA
SCHEMBL1792144 0.91 TDP1 (0.52) TDP1L3MBTL1KDM4EDBHGAA
Formaldehyde SCHEMBL10644284 0.91 TDP1 (0.52) TDP1L3MBTL1KDM4EDBHGAA
Phenol SCHEMBL14718671 0.86 CES2 (0.50) TDP1L3MBTL1KDM4EDBHGAA
SCHEMBL16222220 0.86 ALDH1A1 (0.61) TDP1L3MBTL1KDM4EDBHGAA

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-8574311-B2 Versatile biodegradable elastic polymers featured with dual crosslinking mechanism for biomedical applications BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) 2013-11-05 US disclosed
US-20110124765-A1 Versatile Biodegradable Elastic Polymers Featured with Dual Crosslinking Mechanism for Biomedical Applications BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) 2011-05-26 US disclosed
WO-2009137715-A2 VERSATILE BIODEGRADABLE ELASTIC POLYMERS FEATURED WITH DUAL CROSSLINKING MECHANISM FOR BIOMEDICAL APPLICATIONS BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) 2009-11-12 WO disclosed