SCHEMBL31346241

SCHEMBL31346241

FC1(F)CCN(c2cc(Br)ccn2)CC1

nearest known ligand 0.39

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ADRB1 P08588 1/20 0.39
LRRK2 Q5S007 7/20 0.38
SCN10A Q9Y5Y9 1/20 0.38
PDK1 Q15118 1/20 0.37
PDK2 Q15119 1/20 0.37
OPRD1 P41143 2/20 0.36
WNT1 P04628 1/20 0.36
GSK3B P49841 1/20 0.36
DYRK1A Q13627 1/20 0.36
ACACB O00763 1/20 0.36
CNR2 P34972 1/20 0.36
KIF18A Q8NI77 3/20 0.36
FFAR4 Q5NUL3 1/20 0.36
HRH4 Q9H3N8 1/20 0.36

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
SCHEMBL21812367 1.00 ADRB1 (0.39) ADRB1LRRK2SCN10APDK1PDK2
SCHEMBL30476654 0.80 HRH4 (0.51) ADRB1LRRK2ACACBHRH4
SCHEMBL21812444 0.80 HRH4 (0.47) ADRB1LRRK2ACACBHRH4
SCHEMBL30665756 0.80 HRH4 (0.47) ADRB1LRRK2ACACBHRH4
SCHEMBL789776 0.80 HRH4 (0.51) ADRB1LRRK2ACACBHRH4
SCHEMBL22119280 0.80 OPRD1 (0.54) ADRB1OPRD1KIF18A
SCHEMBL30619312 0.80 OPRD1 (0.54) ADRB1OPRD1KIF18A
SCHEMBL29609326 0.80 GRIN2D (0.50) ADRB1LRRK2PDK1PDK2OPRD1
SCHEMBL24405849 0.79 HRH4 (0.54) ADRB1LRRK2CNR2HRH4
SCHEMBL30701056 0.78 LRRK2 (0.44) LRRK2OPRD1KIF18AFFAR4

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
CN-119317620-A Azacycloalkyl carbonyl cyclic amine compounds 亚力维克希斯股份有限公司 2025-01-14 CN disclosed