SCHEMBL6434620

SCHEMBL6434620

c1ccc(C2SCCCCCCCCCCS2)cc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.43
KDM4E B2RXH2 1/20 0.43
NPC1 O15118 1/20 0.43
RAB9A P51151 1/20 0.43
RECQL P46063 1/20 0.37
FAAH O00519 1/20 0.36
MAOA P21397 6/20 0.34
MAOB P27338 6/20 0.34
KDM1A O60341 4/20 0.34
CYP2C19 P33261 4/20 0.34
CYP2B6 P20813 3/20 0.34
CYP1A2 P05177 2/20 0.34
CYP2D6 P10635 2/20 0.34
CYP2C9 P11712 2/20 0.34
LMNA P02545 1/20 0.34
CYP3A4 P08684 1/20 0.34
HTR1A P08908 1/20 0.34
ADRA2A P08913 1/20 0.34
CYP2A6 P11509 1/20 0.34
SLC6A2 P23975 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
SCHEMBL3096069 0.98 KDM4E (0.44) TSHRKDM4ENPC1RAB9ARECQL
SCHEMBL24705 0.93 KDM4E (0.44) TSHRKDM4ENPC1RAB9ARECQL
SCHEMBL4017099 0.91 KDM4E (0.43) TSHRKDM4ENPC1RAB9ARECQL
SCHEMBL3078602 0.87 KDM4E (0.52) TSHRKDM4ENPC1RAB9AMAOA
SCHEMBL16263640 0.81 NPC1 (0.47) TSHRKDM4ENPC1RAB9AMAOA
SCHEMBL11612135 0.80 KDM1A (0.44) TSHRKDM4ENPC1RAB9AFAAH
SCHEMBL7632848 0.79 TSHR (0.44) TSHRKDM4ENPC1RAB9AFAAH
SCHEMBL16263580 0.79 KDM4E (0.42) TSHRKDM4ENPC1RAB9AMAOA
SCHEMBL10767082 0.76 BRD4 (0.41) MAOAMAOBKDM1ASLC18A3
SCHEMBL9778853 0.76 KDM1A (0.49) TSHRKDM4ENPC1RAB9AMAOA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0814531-B1 Secondary battery CANON KK (JP) 2005-07-20 EP disclosed
US-5714277-A MIXING FLAME RETARDANT MATERIAL INTO ELECTROLYTE CANON KABUSHIKI KAISHA (JP) 1998-02-03 US disclosed
EP-0814531-A2 Secondary battery CANON KABUSHIKI KAISHA (JP) 1997-12-29 EP disclosed
EP-0631339-A2 Secondary battery CANON KABUSHIKI KAISHA (JP) 1994-12-28 EP disclosed