SCHEMBL9230592

SCHEMBL9230592

c1ccc(CN=C2CCN(Cc3ccccc3)C2)cc1

nearest known ligand 0.56

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 4/20 0.50
MEN1 O00255 1/20 0.47
NPC1 O15118 1/20 0.47
RAB9A P51151 1/20 0.47
KMT2A Q03164 1/20 0.47
PNMT P11086 1/20 0.47
KDM4E B2RXH2 1/20 0.46
GAA P10253 1/20 0.46
MAPT P10636 1/20 0.46
MAPK1 P28482 1/20 0.46
ACHE P22303 4/20 0.45
BACE1 P56817 1/20 0.44
CCR3 P51677 1/20 0.44
SLC6A5 Q9Y345 1/20 0.43
MC4R P32245 1/20 0.43

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
SCHEMBL9230590 1.00 SIGMAR1 (0.50) SIGMAR1MEN1NPC1RAB9AKMT2A
SCHEMBL9232557 0.90 SIGMAR1 (0.59) SIGMAR1MEN1NPC1RAB9AKMT2A
SCHEMBL10365169 0.81 SIGMAR1 (0.52) SIGMAR1MEN1NPC1RAB9AKMT2A
SCHEMBL4501237 0.81 SIGMAR1 (0.52) SIGMAR1MEN1NPC1RAB9AKMT2A
SCHEMBL4501240 0.81 SIGMAR1 (0.52) SIGMAR1MEN1NPC1RAB9AKMT2A
Hydrochloric Acid SCHEMBL9005481 0.80 SIGMAR1 (0.50) SIGMAR1MEN1NPC1RAB9AKMT2A
Hydrochloric Acid SCHEMBL9005477 0.80 SIGMAR1 (0.50) SIGMAR1MEN1NPC1RAB9AKMT2A
SCHEMBL21425473 0.78 SIGMAR1 (0.47) SIGMAR1MEN1NPC1RAB9AKMT2A
SCHEMBL31104589 0.78 SIGMAR1 (0.47) SIGMAR1MEN1NPC1RAB9AKMT2A
SCHEMBL22881858 0.74 SIGMAR1 (0.43) SIGMAR1MEN1NPC1RAB9AKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0677522-A1 8-METHOXYQUINOLONECARBOXYLIC ACID DERIVATIVE YOSHITOMI PHARMACEUTICAL INDUSTRIES, LTD. (JP) 1995-10-18 EP disclosed