SCHEMBL27337121

SCHEMBL27337121

CCCCc1c(C)c(N)cc(F)c1C

nearest known ligand 0.42

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
SKP2 Q13309 1/20 0.42
HTT P42858 2/20 0.37
NPC1 O15118 1/20 0.37
HPGD P15428 1/20 0.37
MAPK1 P28482 1/20 0.37
RAB9A P51151 1/20 0.37
NPSR1 Q6W5P4 1/20 0.37
NOS2 P35228 1/20 0.37
SRC P12931 1/20 0.32
MAPT P10636 1/20 0.32
KDM4E B2RXH2 1/20 0.32
PKM P14618 1/20 0.32
TYR P14679 1/20 0.32
TLR8 Q9NR97 2/20 0.30
TLR7 Q9NYK1 1/20 0.30
ALOX5 P09917 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
SCHEMBL8160614 0.74 SKP2 (0.47) SKP2HTTNPC1HPGDMAPK1
SCHEMBL12971475 0.73 SKP2 (0.42) SKP2HTTNPC1HPGDMAPK1
SCHEMBL3668658 0.72 NOS3 (0.31) NOS2
SCHEMBL10342531 0.71 SKP2 (0.57) SKP2HTTNPC1HPGDMAPK1
SCHEMBL27495210 0.71 SKP2 (0.52) SKP2HTTNPC1HPGDMAPK1
SCHEMBL21675414 0.69 NOS2 (0.33) NOS2
SCHEMBL15556560 0.69 SKP2 (0.50) SKP2HTTNPC1HPGDMAPK1
SCHEMBL27603659 0.69 SKP2 (0.42) SKP2HTTNPC1HPGDMAPK1
SCHEMBL5185158 0.69 SKP2 (0.41) SKP2HTTNPC1HPGDMAPK1
SCHEMBL19228627 0.69 HTT (0.43) SKP2HTTNPC1HPGDMAPK1

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-2024130161-A2 NOVEL CAMPTOTHECIN DERIVATIVES AND CONJUGATES THEREOF BIONECURE THERAPEUTICS INC (US) 2024-06-20 WO disclosed