SCHEMBL8664336

SCHEMBL8664336

CCCCCN(C)c1[c]cccc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DNM1 Q05193 3/20 0.38
KCNH2 Q12809 5/20 0.37
GPR84 Q9NQS5 2/20 0.34
SIGMAR1 Q99720 1/20 0.34
NPC1 O15118 1/20 0.33
JAK2 O60674 1/20 0.33
RAB9A P51151 1/20 0.33
PAX8 Q06710 1/20 0.33
MAPT P10636 1/20 0.33
OPRM1 P35372 2/20 0.32
ALDH1A1 P00352 2/20 0.32
ICMT O60725 1/20 0.32
ALB P02768 1/20 0.32
DRD2 P14416 1/20 0.32
DRD3 P35462 1/20 0.32
OPRD1 P41143 1/20 0.32
OPRK1 P41145 1/20 0.32
KDM4E B2RXH2 1/20 0.32
OPRL1 P41146 1/20 0.32
CYP1A2 P05177 1/20 0.32

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
SCHEMBL7771807 0.98 DNM1 (0.41) DNM1KCNH2GPR84SIGMAR1NPC1
SCHEMBL8670477 0.98 DNM1 (0.41) DNM1KCNH2GPR84SIGMAR1NPC1
SCHEMBL7770558 0.98 DNM1 (0.41) DNM1KCNH2GPR84SIGMAR1NPC1
SCHEMBL3452063 0.98 DNM1 (0.41) DNM1KCNH2GPR84SIGMAR1NPC1
SCHEMBL2448855 0.95 MAPT (0.37) KCNH2SIGMAR1MAPTOPRM1ALDH1A1
SCHEMBL4722361 0.87 TP53 (0.33) KCNH2SIGMAR1DRD3
SCHEMBL1077660 0.84 KCNH2 (0.38) DNM1KCNH2SIGMAR1NPC1JAK2
SCHEMBL9800560 0.82 KCNH2 (0.40) DNM1KCNH2SIGMAR1NPC1JAK2
SCHEMBL2460597 0.82 KCNH2 (0.40) DNM1KCNH2SIGMAR1NPC1JAK2
SCHEMBL8643073 0.82 KCNH2 (0.40) DNM1KCNH2SIGMAR1NPC1JAK2

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
CN-101778828-A Azolylmethylenehydrazine derivatives and uses thereof KAKEN PHARMA CO LTD 2010-07-14 CN disclosed
US-5750552-A ANTIULCER AGENTS ARAX CO., LTD. (JP) 1998-05-12 US disclosed
US-5733922-A Imidazole derivative, pharmaceutically acceptable salt thereof, and anti-ulcer drug including such derivative or salt ARAX CO., LTD. (JP) 1998-03-31 US disclosed
EP-0736527-A1 Imadazoline derivative, possible tautomer thereof, process of manufacturing therefor, and vulnerary including such derivative or tautomer ARAX CO., LTD. (JP) 1996-10-09 EP disclosed
EP-0728747-A1 Imidazole derivative, pharmaceutically acceptable salt thereof, process of manufacture therefor, and anti-ulcer drug including such derivative or salt ARAX CO., LTD. (JP) 1996-08-28 EP disclosed