SCHEMBL18855893

SCHEMBL18855893

CCC1CCC(Oc2cnc(C#N)cn2)C1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 1/20 0.47
TRPC3 Q13507 1/20 0.35
TRPC6 Q9Y210 1/20 0.35
CHEK1 O14757 12/20 0.34
KCNH2 Q12809 4/20 0.33
CHEK2 O96017 3/20 0.33
HRH3 Q9Y5N1 1/20 0.33
RPS6KA3 P51812 2/20 0.31
SRPK1 Q96SB4 2/20 0.31
PLK4 O00444 1/20 0.31
PDPK1 O15530 1/20 0.31
MAP4K4 O95819 1/20 0.31
CSF1R P07333 1/20 0.31
RET P07949 1/20 0.31
FER P16591 1/20 0.31
FLT4 P35916 1/20 0.31
KDR P35968 1/20 0.31
FLT3 P36888 1/20 0.31
CLK2 P49760 1/20 0.31
GSK3B P49841 1/20 0.31

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
SCHEMBL18855597 1.00 GPR119 (0.47) GPR119TRPC3TRPC6CHEK1KCNH2
SCHEMBL18855854 0.81 DPP4 (0.44) TRPC3TRPC6KCNH2HRH3DGAT1
SCHEMBL24242875 0.76 GPR119 (0.51) GPR119TRPC3TRPC6CHEK1KCNH2
SCHEMBL30991254 0.76 GPR119 (0.44) GPR119TRPC3TRPC6CHEK1KCNH2
SCHEMBL21645375 0.76 GPR119 (0.44) GPR119TRPC3TRPC6CHEK1KCNH2
Hydrochloric Acid SCHEMBL30991239 0.75 GPR119 (0.43) GPR119TRPC3TRPC6CHEK1KCNH2
Hydrochloric Acid SCHEMBL21645371 0.75 GPR119 (0.43) GPR119TRPC3TRPC6CHEK1KCNH2
SCHEMBL31143103 0.72 CHEK1 (0.40) GPR119CHEK1PDE4D
SCHEMBL31656637 0.72 GPR119 (0.44) GPR119TRPC3TRPC6CHEK1KCNH2
SCHEMBL18855856 0.71 HRH3 (0.58) GPR119HRH3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3950692-A1 NOVEL TRICYCLIC COMPOUNDS AbbVie Inc. (US) 2022-02-09 EP disclosed
EP-2506716-B1 NOVEL TRICYCLIC COMPOUNDS ABBVIE INC (US) 2017-05-17 EP disclosed