SCHEMBL1754769

SCHEMBL1754769

CN(CCS)CCCN(C)CCS

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.53
CA12 O43570 1/20 0.44
CA2 P00918 1/20 0.44
CA3 P07451 1/20 0.44
CA4 P22748 1/20 0.44
CA6 P23280 1/20 0.44
CA5A P35218 1/20 0.44
CA7 P43166 1/20 0.44
CA9 Q16790 1/20 0.44
CA14 Q9ULX7 1/20 0.44
CA5B Q9Y2D0 1/20 0.44
CHRM2 P08172 2/20 0.41
TSHR P16473 2/20 0.37
ALDH1A1 P00352 1/20 0.37
MAPT P10636 1/20 0.35
LMNA P02545 1/20 0.33
TP53 P04637 1/20 0.33
HTT P42858 1/20 0.33
HBB P68871 1/20 0.33
SIGMAR1 Q99720 2/20 0.31

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
SCHEMBL2462100 0.89
SCHEMBL11223201 0.86 TDP1 (0.60) TDP1CA12CA2CA3CA4
SCHEMBL8427956 0.85
SCHEMBL7191930 0.83
SCHEMBL7211466 0.83 DNM1 (0.55) TDP1CA12CA2CA3CA4
SCHEMBL23390588 0.81 DNM1 (0.59) TDP1CHRM2TSHRALDH1A1DNM1
SCHEMBL7902686 0.81 DNM1 (0.59) TDP1CHRM2TSHRALDH1A1DNM1
SCHEMBL10827672 0.80 CA12 (0.73) TDP1CA12CA2CA3CA4
SCHEMBL26226456 0.79 TDP1 (0.39) TDP1CA12CA2CA3CA4
SCHEMBL272639 0.79 TSHR (0.60) TDP1CA12CA2CA3CA4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2022045290-A1 ELECTRODE CATALYST, MANUFACTURING METHOD THEREFOR, AND FUEL CELL 国立研究開発法人科学技術振興機構 2022-03-03 WO disclosed
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