SCHEMBL1844820

SCHEMBL1844820

CC1N(C)CCN1c1ccccc1.C[N+]1=CN(Cc2ccccc2)CC1

nearest known ligand 0.35

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 1/20 0.35
ACHE P22303 2/20 0.35
MC4R P32245 1/20 0.33
LMNA P02545 2/20 0.33
DRD4 P21917 1/20 0.33
POLB P06746 1/20 0.33
OPRM1 P35372 1/20 0.31
SIGMAR1 Q99720 1/20 0.31
SLC6A2 P23975 1/20 0.31
SLC6A4 P31645 1/20 0.31
SLC6A3 Q01959 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
HRH3 Q9Y5N1 1/20 0.30
GBA1 P04062 1/20 0.30

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
SCHEMBL1836416 0.81 LMNA (0.46) ACHEMC4RLMNADRD4POLB
SCHEMBL1835246 0.77 MAPK1 (0.47) MAPK1SIGMAR1SMN1; SMN2HRH3
SCHEMBL28396396 0.76 POLB (0.41) ACHEMC4RLMNADRD4POLB
SCHEMBL1844821 0.73 DRD4 (0.35) ACHEMC4RLMNADRD4POLB
SCHEMBL1844822 0.73 MC4R (0.53) MAPK1ACHEMC4RLMNADRD4
SCHEMBL12254378 0.66 MAPK1 (0.49) MAPK1LMNAPOLBSIGMAR1SLC6A2
SCHEMBL1834264 0.66 ACHE (0.49) ACHEMC4RSIGMAR1
SCHEMBL22055634 0.62 MAPK1 (0.46) MAPK1SIGMAR1SMN1; SMN2HRH3
SCHEMBL13319085 0.62 SIGMAR1 (0.44) ACHEMC4RLMNADRD4POLB
SCHEMBL25154370 0.62 MAPK1 (0.66) MAPK1ACHEMC4RLMNADRD4

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-2323144-A1 Electrolytic capacitor MITSUBISHI CHEMICAL CORPORATION (JP) 2011-05-18 EP disclosed