SCHEMBL2727337

SCHEMBL2727337

CCCCn1nn[nH]c1=S

nearest known ligand 0.42

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 8/20 0.42
HPGD P15428 7/20 0.42
LMNA P02545 4/20 0.42
APOBEC3G Q9HC16 3/20 0.42
GFER P55789 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
KDM4E B2RXH2 1/20 0.39
ALOX12 P18054 2/20 0.37
SMN1; SMN2 Q16637 2/20 0.37
MEN1 O00255 3/20 0.37
KMT2A Q03164 3/20 0.37
GAA P10253 2/20 0.37
SLC9A1 P19634 1/20 0.37
GLA P06280 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36

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
SCHEMBL1248798 0.94 ALDH1A1 (0.39) ALDH1A1HPGDLMNAAPOBEC3GGFER
SCHEMBL9597914 0.79 APOBEC3G (0.44) ALDH1A1HPGDAPOBEC3GTDP1KDM4E
SCHEMBL13315556 0.78 TOP2A (0.37) ALDH1A1TDP1MEN1KMT2AGAA
SCHEMBL16919064 0.73 ALDH1A1 (0.40) ALDH1A1HPGDAPOBEC3GTDP1KDM4E
SCHEMBL7603424 0.72 SLC9A1 (0.38) ALDH1A1LMNAGAASLC9A1
SCHEMBL14557322 0.68 SLC9A1 (0.38) ALDH1A1APOBEC3GMEN1KMT2ASLC9A1
SCHEMBL11473782 0.67 PLK1 (0.38) ALDH1A1GFERKDM4EGAA
SCHEMBL16325249 0.64 SLC9A1 (0.38) ALDH1A1APOBEC3GKDM4EKMT2AGAA
SCHEMBL11424373 0.64 ALDH1A1 (0.41) ALDH1A1HPGDLMNAAPOBEC3GGFER
SCHEMBL2091620 0.64 KMT2A (0.47) ALDH1A1LMNAMEN1KMT2AGAA

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-20130209915-A1 ELECTROLYTE SOLUTION FOR LITHIUM BATTERY, LITHIUM BATTERY INCLUDING ELECTROLYTE SOLUTION, ELECTROLYTE SOLUTION FOR LITHIUM AIR BATTERY, AND LITHIUM AIR BATTERY INCLUDING ELECTROLYTE SOLUTION NATIONAL UNIVERSITY CORPORATION NAGOYA INSTITUTE OF TECHNOLOGY (JP) 2013-08-15 US disclosed
US-20130209915-A1 ELECTROLYTE SOLUTION FOR LITHIUM BATTERY, LITHIUM BATTERY INCLUDING ELECTROLYTE SOLUTION, ELECTROLYTE SOLUTION FOR LITHIUM AIR BATTERY, AND LITHIUM AIR BATTERY INCLUDING ELECTROLYTE SOLUTION NATIONAL UNIVERSITY CORPORATION NAGOYA INSTITUTE OF TECHNOLOGY (JP) 2013-08-15 US disclosed
WO-2012056292-A1 ELECTROLYTE SOLUTION FOR LITHIUM BATTERY, LITHIUM BATTERY INCLUDING ELECTROLYTE SOLUTION, ELECTROLYTE SOLUTION FOR LITHIUM AIR BATTERY, AND LITHIUM AIR BATTERY INCLUDING ELECTROLYTE SOLUTION TOYOTA JIDOSHA KABUSHIKI KAISHA (JP) 2012-05-03 WO disclosed
WO-2012056292-A1 ELECTROLYTE SOLUTION FOR LITHIUM BATTERY, LITHIUM BATTERY INCLUDING ELECTROLYTE SOLUTION, ELECTROLYTE SOLUTION FOR LITHIUM AIR BATTERY, AND LITHIUM AIR BATTERY INCLUDING ELECTROLYTE SOLUTION TOYOTA JIDOSHA KABUSHIKI KAISHA (JP) 2012-05-03 WO disclosed
US-5240811-A Photogenerated polycarbodiimides from poly(tetrazole-5-thiones) and use in the preparation of coatings and deep-UV photoresists OCG MICROELECTRONIC MATERIALS, INC. (US) 1993-08-31 US disclosed