SCHEMBL512944

SCHEMBL512944

CCSSNCc1ccccc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 2/20 0.45
MAPT P10636 2/20 0.45
KDM4E B2RXH2 1/20 0.45
ADH1B P00325 1/20 0.42
ADH1C P00326 1/20 0.42
ADH1A P07327 1/20 0.42
ADH7 P40394 1/20 0.42
IDO1 P14902 3/20 0.41
THRB P10828 1/20 0.41
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
TP53 P04637 1/20 0.41
HTT P42858 1/20 0.38
SIGMAR1 Q99720 1/20 0.38
HPGD P15428 2/20 0.38
ALOX12 P18054 2/20 0.38
ALPL P05186 1/20 0.38
GAA P10253 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38

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
SCHEMBL11360130 0.82 IDO1 (0.52) CYP3A4MAPTKDM4EADH1BADH1C
SCHEMBL24497367 0.78 CYP3A4 (0.48) CYP3A4MAPTKDM4EADH1BADH1C
SCHEMBL5703344 0.77 PPID (0.33) CYP3A4MAPTKDM4EIDO1THRB
SCHEMBL5703140 0.74 THRB (0.33) CYP3A4MAPTKDM4EIDO1THRB
SCHEMBL109301 0.73 CYP3A4 (0.52) CYP3A4MAPTKDM4EADH1BADH1C
Hydrochloric Acid SCHEMBL10435079 0.71 MAPT (0.56) CYP3A4MAPTKDM4EADH1BADH1C
SCHEMBL10546636 0.71 TP53 (0.41) CYP3A4MAPTKDM4EIDO1KMT2A
SCHEMBL14724375 0.71 CYP3A4 (0.45) CYP3A4MAPTKDM4EIDO1THRB
SCHEMBL576943 0.69 TP53 (0.48) CYP3A4IDO1TP53ALDH1A1CA12
SCHEMBL21034357 0.69 IDO1 (0.48) CYP3A4MAPTKDM4EADH1BADH1C

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-20200411933-A1 SOLUBLE OXYGEN EVOLVING CATALYSTS FOR RECHARGEABLE METAL-AIR BATTERIES LIOX POWER INC (US) 2020-12-31 US disclosed
EP-2561573-B1 SOLUBLE OXYGEN EVOLVING CATALYSTS FOR RECHARGEABLE METAL-AIR BATTERIES LIOX POWER INC (US) 2020-03-25 EP disclosed
EP-2561573-A1 SOLUBLE OXYGEN EVOLVING CATALYSTS FOR RECHARGEABLE METAL-AIR BATTERIES Liox Power, Inc. (US) 2013-02-27 EP disclosed
US-20120028137-A1 SOLUBLE OXYGEN EVOLVING CATALYSTS FOR RECHARGEABLE METAL-AIR BATTERIES LIOX POWER, INC. 2012-02-02 US disclosed
WO-2011133982-A1 SOLUBLE OXYGEN EVOLVING CATALYSTS FOR RECHARGEABLE METAL-AIR BATTERIES LIOX POWER, INC. (US) 2011-10-27 WO disclosed