SCHEMBL24254930

SCHEMBL24254930

NC12CC3CC(N)(C1)C(N)(C3)C2

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GRIN1 Q05586 8/20 0.53
GRIN2A Q12879 8/20 0.53
GRIN2D O15399 7/20 0.53
GRIN3B O60391 7/20 0.53
GRIN2B Q13224 7/20 0.53
GRIN2C Q14957 7/20 0.53
GRIN3A Q8TCU5 7/20 0.53
LMNA P02545 4/20 0.53
SLC22A1 O15245 2/20 0.53
NFKB1 P19838 2/20 0.53
SLC22A2 O15244 1/20 0.53
TSHR P16473 1/20 0.53
STAT6 P42226 1/20 0.53
SLC47A1 Q96FL8 1/20 0.53
SIGMAR1 Q99720 1/20 0.53
CYP2C9 P11712 2/20 0.52
ESR1 P03372 1/20 0.52
ADRB3 P13945 1/20 0.52
ACHE P22303 1/20 0.52
OPRK1 P41145 1/20 0.52

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
SCHEMBL4851089 0.83 GRIN1 (0.62) GRIN1GRIN2AGRIN2DGRIN3BGRIN2B
SCHEMBL12604983 0.79
Hydrochloric Acid SCHEMBL17453367 0.75
Iodide SCHEMBL23880344 0.75
Amantadine SCHEMBL4846924 0.75 GRIN1 (0.81) GRIN1GRIN2AGRIN2DGRIN3BGRIN2B
SCHEMBL21376250 0.71 GRIN1 (0.61) GRIN1GRIN2AGRIN2DGRIN3BGRIN2B
Amantadine SCHEMBL21310017 0.69 GRIN1 (1.00) GRIN1GRIN2AGRIN2DGRIN3BGRIN2B
Amantadine SCHEMBL21309814 0.69 GRIN1 (1.00) GRIN1GRIN2AGRIN2DGRIN3BGRIN2B
Amantadine SCHEMBL4098 0.69 GRIN1 (1.00) GRIN1GRIN2AGRIN2DGRIN3BGRIN2B
Amantadine SCHEMBL15532073 0.69 GRIN1 (1.00) GRIN1GRIN2AGRIN2DGRIN3BGRIN2B

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
WO-2022034907-A1 METAL PATTERNING MATERIAL, AMINE COMPOUND, ELECTRONIC DEVICE, AND METHOD FOR FORMING METAL PATTERN 東ソー株式会社 2022-02-17 WO disclosed