SCHEMBL25967656

SCHEMBL25967656

Cc1ccc(N2CCC(COc3cccc4c3CSC(=O)N4)CC2)c(F)c1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC6A9 P48067 4/20 0.38
EGFR P00533 1/20 0.35
FGFR1 P11362 1/20 0.35
FLT1 P17948 1/20 0.35
FLT4 P35916 1/20 0.35
KDR P35968 1/20 0.35
RBP4 P02753 1/20 0.35
TTR P02766 1/20 0.35
KCNH2 Q12809 1/20 0.34
CRBN Q96SW2 6/20 0.34
DDB1 Q16531 5/20 0.34
IKZF3 Q9UKT9 4/20 0.34
ADRA1D P25100 2/20 0.34
ADRA1A P35348 2/20 0.34
ADRA1B P35368 2/20 0.34
DRD2 P14416 1/20 0.34
ACACB O00763 2/20 0.34
C5AR1 P21730 1/20 0.34
DGAT1 O75907 1/20 0.34
FFAR1 O14842 1/20 0.33

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
SCHEMBL20613076 0.88 SLC6A9 (0.39) SLC6A9EGFRFGFR1FLT1FLT4
SCHEMBL25968327 0.83 SLC6A9 (0.41) SLC6A9EGFRFGFR1FLT1FLT4
SCHEMBL25967400 0.80 SLC6A9 (0.36) SLC6A9EGFRFGFR1FLT1FLT4
SCHEMBL25967209 0.79 SLC6A9 (0.39) SLC6A9EGFRFGFR1FLT1FLT4
SCHEMBL25967424 0.77 FFAR4 (0.40) C5AR1HTR1D
SCHEMBL25967371 0.74 FFAR4 (0.43) C5AR1HTR1D
SCHEMBL20613070 0.72 ADRB1 (0.42) SLC6A9ADRA1DADRA1AADRA1BDRD2
SCHEMBL20613010 0.71 KDM4E (0.31)
SCHEMBL20597094 0.71 TRPV4 (0.34) CRBNDDB1IKZF3ADRA1DADRA1A
SCHEMBL30116171 0.71 TRPV4 (0.34) CRBNDDB1IKZF3ADRA1DADRA1A

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-3421454-B9 PIPERIDINE DERIVATIVE OTSUKA PHARMA CO LTD (JP) 2023-08-09 EP disclosed