SCHEMBL27430722

SCHEMBL27430722

CN1CCN(c2nc(Nc3cccc(C4CC4)c3)c3nccnc3n2)CC1

nearest known ligand 0.44

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ HTR2C P28335 6/20 0.44
▸ HTR2A P28223 3/20 0.44
▸ HRH4 Q9H3N8 1/20 0.44
▸ L3MBTL1 Q9Y468 1/20 0.43
▸ SRC P12931 4/20 0.40
▸ CTSC P53634 1/20 0.40
▸ USP2 O75604 1/20 0.40
▸ SMN1; SMN2 Q16637 1/20 0.40
▸ HPGD P15428 1/20 0.39
▸ FLT3 P36888 2/20 0.39
▸ ABL1 P00519 1/20 0.38
▸ BTK Q06187 1/20 0.38
▸ KHK P50053 1/20 0.38

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
SCHEMBL27248330 0.85 L3MBTL1 (0.58) HTR2CHTR2AHRH4L3MBTL1SRC
SCHEMBL27248319 0.84 HRH4 (0.46) HTR2CHTR2AHRH4L3MBTL1CTSC
SCHEMBL27429695 0.84 HRH4 (0.49) HTR2CHTR2AHRH4L3MBTL1CTSC
SCHEMBL27429805 0.83 HRH4 (0.41) HTR2CHTR2AHRH4L3MBTL1SRC
SCHEMBL27430647 0.83 HRH4 (0.41) HTR2CHTR2AHRH4L3MBTL1SRC
SCHEMBL27430721 0.83 HRH4 (0.41) HTR2CHTR2AHRH4L3MBTL1SRC
SCHEMBL27430744 0.83 HRH4 (0.41) HTR2CHTR2AHRH4L3MBTL1SRC
SCHEMBL27430646 0.83 HRH4 (0.41) HTR2CHTR2AHRH4L3MBTL1SRC
SCHEMBL27429710 0.82 HTR2C (0.64) HTR2CHTR2AHRH4SRCSMN1; SMN2
SCHEMBL30879557 0.82 HTR2C (0.42) HTR2CHTR2AHRH4L3MBTL1SRC

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-2024118607-A1 COMPOUNDS, COMPOSITIONS, AND METHODS CHDI FOUNDATION, INC. (US) 2024-06-06 — — WO disclosed
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