SCHEMBL25625900

SCHEMBL25625900

CC(C)c1ncnn1CCOCCO

nearest known ligand 0.35

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ HTT P42858 2/20 0.35
▸ HTR1A P08908 1/20 0.34
▸ MEN1 O00255 3/20 0.33
▸ KMT2A Q03164 3/20 0.33
▸ TSHR P16473 2/20 0.32
▸ MAPK1 P28482 1/20 0.31
▸ SMN1; SMN2 Q16637 1/20 0.30
▸ THRB P10828 1/20 0.30
▸ MAPT P10636 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
SCHEMBL25745016 0.76 — —
SCHEMBL24768869 0.75 — —
SCHEMBL25619080 0.75 MEN1 (0.36) HTTHTR1AMEN1KMT2ATSHR
SCHEMBL25744942 0.73 — —
SCHEMBL25619102 0.73 SMN1; SMN2 (0.33) SMN1; SMN2
SCHEMBL25857845 0.71 KMT2A (0.34) MEN1KMT2ATSHRSMN1; SMN2MAPT
SCHEMBL25744940 0.70 SMN1; SMN2 (0.31) SMN1; SMN2
SCHEMBL25744941 0.70 — —
SCHEMBL25619100 0.70 UBE2M (0.39) —
SCHEMBL24768960 0.69 TLR9 (0.31) SMN1; SMN2

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-2023097187-A1 AMPK ACTIVATORS KALLYOPE, INC. (US) 2023-06-01 — — WO disclosed
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