SCHEMBL24630463

SCHEMBL24630463

CCCN1CCN(CN2CCN(C(C)CC)CC2)CC1

nearest known ligand 0.35

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 6/20 0.35
SIGMAR1 Q99720 2/20 0.35
KDM4E B2RXH2 3/20 0.33
OPRD1 P41143 1/20 0.31
KCNJ1 P48048 1/20 0.31
KCNH2 Q12809 1/20 0.31
GPR183 P32249 1/20 0.31
DRD3 P35462 2/20 0.30
MEN1 O00255 1/20 0.30
KMT2A Q03164 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
SCHEMBL10284004 0.94 DRD2 (0.38) DRD2SIGMAR1KDM4EOPRD1KCNJ1
SCHEMBL13412948 0.78 DRD2 (0.36) DRD2SIGMAR1OPRD1KCNJ1KCNH2
SCHEMBL11575106 0.78
SCHEMBL15348806 0.78 KDM4E (0.42) KDM4EGPR183MEN1KMT2A
SCHEMBL2738294 0.76 DAO (0.43) DRD2SIGMAR1OPRD1KCNH2DRD3
SCHEMBL12850091 0.76 KDM4E (0.37) KDM4EGPR183MEN1KMT2A
Hydrochloric Acid SCHEMBL1920270 0.76 KDM4E (0.33) KDM4EKCNJ1KCNH2GPR183MEN1
SCHEMBL27279915 0.74 CARM1 (0.52) SIGMAR1
SCHEMBL20254465 0.74 DAO (0.46) DRD2SIGMAR1OPRD1KCNH2DRD3
SCHEMBL18500499 0.74 DRD2 (0.39) DRD2SIGMAR1KDM4EOPRD1DRD3

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-2022150555-A2 METHODS AND COMPOUNDS FOR TREATING FRIEDREICH'S ATAXIA Design Therapeutics, Inc. (US) 2022-07-14 WO disclosed