SCHEMBL28628765

SCHEMBL28628765

OC1CCCC1c1cc[c]cc1

nearest known ligand 0.40

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
AR P10275 3/20 0.40
SLC18A3 Q16572 4/20 0.37
ESR2 Q92731 1/20 0.32
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32

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
SCHEMBL4618388 0.96 AR (0.43) ARSLC18A3MEN1KMT2A
SCHEMBL6574591 0.80 MEN1 (0.41) MEN1KMT2A
SCHEMBL17846316 0.78 SLC18A3 (0.54) SLC18A3MEN1KMT2A
SCHEMBL15178310 0.78 SLC18A3 (0.54) SLC18A3MEN1KMT2A
SCHEMBL4606955 0.78 SLC18A3 (0.54) SLC18A3MEN1KMT2A
SCHEMBL4606954 0.78 SLC18A3 (0.54) SLC18A3MEN1KMT2A
SCHEMBL4606959 0.78 SLC18A3 (0.54) SLC18A3MEN1KMT2A
SCHEMBL17846315 0.78 SLC18A3 (0.54) SLC18A3MEN1KMT2A
Water SCHEMBL27287120 0.77 SLC18A3 (0.57) ARSLC18A3MEN1KMT2A
SCHEMBL25341890 0.75 SLC18A3 (0.49) ARSLC18A3

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-105980386-B Pyrazolo compounds and uses thereof 基因泰克公司 2021-08-13 CN claimed