SCHEMBL16908930

SCHEMBL16908930

CC(=O)N(C(=N)NC(=N)N)c1ccccc1

nearest known ligand 0.39

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CRHBP P24387 1/20 0.39
CRHR2 Q13324 1/20 0.39
PLAU P00749 1/20 0.36
MTNR1A P48039 1/20 0.36
MTNR1B P49286 1/20 0.36
APAF1 O14727 1/20 0.35
NPC1 O15118 1/20 0.35
NPSR1 Q6W5P4 1/20 0.34
GAA P10253 1/20 0.34
KMT2A Q03164 4/20 0.34
MEN1 O00255 3/20 0.34
ALDH1A1 P00352 4/20 0.34
TSHR P16473 3/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
HTT P42858 1/20 0.33
LMNA P02545 1/20 0.33
GLA P06280 1/20 0.33
NQO2 P16083 1/20 0.33

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
Hydrochloric Acid SCHEMBL16908925 0.98 CRHBP (0.38) CRHBPCRHR2PLAUMTNR1AMTNR1B
SCHEMBL28899703 0.77 ALDH1A1 (0.38) PLAUNPC1NPSR1KMT2AMEN1
SCHEMBL2943261 0.76 CRHBP (0.46) CRHBPCRHR2MTNR1AMTNR1BAPAF1
SCHEMBL28515349 0.76 NPSR1 (0.36) PLAUNPSR1KMT2AMEN1ALDH1A1
SCHEMBL130476 0.75 CRHBP (0.56) CRHBPCRHR2MTNR1AMTNR1BAPAF1
SCHEMBL1741633 0.75 LMNA (0.44) PLAUKMT2AMEN1ALDH1A1L3MBTL1
SCHEMBL3058170 0.74 ALDH1A1 (0.48) NPC1NPSR1GAAKMT2AMEN1
Hydrochloric Acid SCHEMBL28340528 0.74 LMNA (0.43) PLAUKMT2AMEN1ALDH1A1L3MBTL1
SCHEMBL13760588 0.73 PLAU (0.41) CRHBPCRHR2PLAUMTNR1AMTNR1B
SCHEMBL27736663 0.73 ALDH1A1 (0.52) CRHBPCRHR2MTNR1AMTNR1BAPAF1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101139509-B Monocomponent epoxide-resin rubber adhesive and preparation method thereof UNIV WUHAN TECH 2011-08-31 CN claimed
CN-101139509-A Monocomponent epoxide-resin rubber adhesive and preparation method thereof UNIV WUHAN TECH (CN) 2008-03-12 CN claimed
US-20150203812-A1 Inhibitors of Voltage Gated Ion Channels THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2015-07-23 US disclosed
CN-103911108-B Single-component epoxy resin adhesive and preparation method thereof UNIV ZHENGZHOU 2015-06-10 CN disclosed
CN-103911108-A Single-component epoxy resin adhesive and preparation method thereof UNIV ZHENGZHOU 2014-07-09 CN disclosed
CN-101139509-B Monocomponent epoxide-resin rubber adhesive and preparation method thereof UNIV WUHAN TECH 2011-08-31 CN disclosed
CN-101139509-A Monocomponent epoxide-resin rubber adhesive and preparation method thereof UNIV WUHAN TECH (CN) 2008-03-12 CN disclosed