SCHEMBL24820619

SCHEMBL24820619

CC1CCC(C)CCC(n2nc3ccccn3c2=O)CC1

nearest known ligand 0.38

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ KCNH2 Q12809 4/20 0.38
▸ SCN5A Q14524 4/20 0.38
▸ RXFP1 Q9HBX9 2/20 0.37
▸ NPC1 O15118 1/20 0.37
▸ RAB9A P51151 1/20 0.37
▸ GPR139 Q6DWJ6 3/20 0.35
▸ HTR1A P08908 2/20 0.35
▸ DRD2 P14416 2/20 0.35
▸ HTR2A P28223 2/20 0.35
▸ HTR6 P50406 2/20 0.35
▸ HTR7 P34969 1/20 0.35
▸ ADORA3 P0DMS8 2/20 0.35
▸ MEN1 O00255 1/20 0.35
▸ ALDH1A1 P00352 1/20 0.35
▸ MAPT P10636 1/20 0.35
▸ KMT2A Q03164 1/20 0.35
▸ SMN1; SMN2 Q16637 1/20 0.35
▸ ADORA2A P29274 1/20 0.34
▸ IRAK4 Q9NWZ3 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
SCHEMBL24819773 0.94 KCNH2 (0.39) KCNH2SCN5ARXFP1NPC1RAB9A
SCHEMBL13063803 0.70 ADORA3 (0.46) KCNH2RXFP1NPC1GPR139HTR1A
SCHEMBL25199276 0.70 AHR (0.33) —
SCHEMBL25512533 0.70 GPR139 (0.33) KCNH2GPR139MAPT
SCHEMBL21477243 0.70 CRBN (0.51) ALDH1A1
SCHEMBL22564943 0.69 AR (0.35) KCNH2SCN5AMAPT
SCHEMBL22564922 0.69 PGR (0.47) —
SCHEMBL30592053 0.69 GPR139 (0.33) KCNH2SCN5AGPR139IRAK4
SCHEMBL8269036 0.66 MEN1 (0.40) MEN1ALDH1A1MAPTKMT2ASMN1; SMN2
SCHEMBL8339813 0.66 MEN1 (0.40) MEN1ALDH1A1MAPTKMT2ASMN1; 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-2022272248-A1 CBL-B MODULATORS AND USES THEREOF NIMBUS CLIO, INC. (US) 2022-12-29 — — WO disclosed
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