SCHEMBL1754768

SCHEMBL1754768

CC(CS)(CS)CSCc1ccccc1

nearest known ligand 0.52

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CYP2D6 P10635 3/20 0.43
CYP1A2 P05177 2/20 0.43
CYP3A4 P08684 2/20 0.43
PRMT1 Q99873 1/20 0.43
ACE P12821 1/20 0.39
CYP2C19 P33261 2/20 0.39
IDO1 P14902 2/20 0.38
CYP2C9 P11712 1/20 0.38
SLC6A2 P23975 1/20 0.36
TAAR1 Q96RJ0 1/20 0.36
LMNA P02545 1/20 0.34
NOS3 P29474 1/20 0.34
NOS1 P29475 1/20 0.34
NOS2 P35228 1/20 0.34
ALDH1A1 P00352 1/20 0.34

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
SCHEMBL1691930 0.79 CYP2D6 (0.48) CYP2D6CYP1A2CYP3A4PRMT1CYP2C19
SCHEMBL31489064 0.76 CYP1A2 (0.46) CYP2D6CYP1A2CYP3A4PRMT1ACE
SCHEMBL25006979 0.74 CYP2D6 (0.44) CYP2D6CYP1A2CYP3A4PRMT1CYP2C19
Hydrochloric Acid SCHEMBL8910510 0.74 SLC6A2 (0.52) CYP2D6CYP1A2CYP3A4PRMT1CYP2C19
SCHEMBL979134 0.73 CYP1A2 (0.40) CYP2D6CYP1A2CYP3A4PRMT1ACE
SCHEMBL9681036 0.72 IDO1 (0.50) CYP2D6CYP1A2CYP3A4CYP2C19IDO1
SCHEMBL9171687 0.72 CYP2C19 (0.50) CYP2D6CYP1A2CYP3A4PRMT1ACE
SCHEMBL4096949 0.72 CYP1A2 (0.42) CYP2D6CYP1A2CYP3A4PRMT1CYP2C19
SCHEMBL1713309 0.71 CES1 (0.44) CYP2D6CYP1A2CYP3A4PRMT1CYP2C19
SCHEMBL206 0.71 CYP2C19 (0.56) CYP2D6CYP1A2CYP3A4CYP2C19IDO1

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
US-10910654-B2 Electric power generation method using electrode catalyst for fuel cell JAPAN SCIENCE AND TECHNOLOGY AGENCY (JP) 2021-02-02 US disclosed
US-20170271686-A1 ELECTRIC POWER GENERATION METHOD USING ELECTRODE CATALYST FOR FUEL CELL JAPAN SCIENCE AND TECHNOLOGY AGENCY (JP) 2017-09-21 US disclosed
US-20170271686-A1 ELECTRIC POWER GENERATION METHOD USING ELECTRODE CATALYST FOR FUEL CELL JAPAN SCIENCE AND TECHNOLOGY AGENCY (JP) 2017-09-21 US disclosed
EP-2442389-B1 ELECTRODE CATALYST FOR FUEL CELL AND USE THEREOF JAPAN SCIENCE & TECH AGENCY (JP) 2016-07-20 EP disclosed
US-20120100462-A1 ELECTRODE CATALYST FOR FUEL CELL AND USE THEREOF JAPAN SCIENCE AND TECHNOLOGY AGENCY (JP) 2012-04-26 US disclosed
US-20120100462-A1 ELECTRODE CATALYST FOR FUEL CELL AND USE THEREOF JAPAN SCIENCE AND TECHNOLOGY AGENCY (JP) 2012-04-26 US disclosed
EP-2442389-A1 ELECTRODE CATALYST FOR FUEL CELL AND USE THEREOF Japan Science And Technology Agency (JP) 2012-04-18 EP disclosed