SCHEMBL27358451

SCHEMBL27358451

CN1CCOc2c(F)cccc21

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.45
PKM P14618 1/20 0.45
PKLR P30613 1/20 0.45
RAB9A P51151 1/20 0.45
HTR6 P50406 3/20 0.45
PIK3CD O00329 2/20 0.40
PIK3CB P42338 1/20 0.40
PIK3CG P48736 1/20 0.40
NOTUM Q6P988 1/20 0.39
CSF1R P07333 2/20 0.38
CDK4 P11802 2/20 0.38
CDK6 Q00534 2/20 0.38
KDM4E B2RXH2 1/20 0.37
ALDH1A1 P00352 1/20 0.37
HPGD P15428 1/20 0.37
HSD17B10 Q99714 1/20 0.37
FGB P02675 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
GRM5 P41594 1/20 0.35
CYP11B1 P15538 1/20 0.35

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
SCHEMBL8593458 0.84 L3MBTL1 (0.46) PIK3CDNOTUMFGBL3MBTL1
SCHEMBL27259961 0.79 NOTUM (0.60) NPC1PKMPKLRRAB9AHTR6
SCHEMBL22717412 0.79 NOTUM (0.39) NPC1PKMPKLRRAB9AHTR6
SCHEMBL23384700 0.79 NOTUM (0.39) NPC1PKMPKLRRAB9AHTR6
SCHEMBL3595427 0.79 HTR6 (0.51) HTR6NOTUMFGBL3MBTL1GRM5
SCHEMBL27259965 0.79 CSF1R (0.38) NPC1PKMPKLRRAB9AHTR6
SCHEMBL13180251 0.78 PIK3CB (0.40) HTR6PIK3CDPIK3CBPIK3CGNOTUM
SCHEMBL13145758 0.78 HTR6 (0.42) NPC1PKMPKLRRAB9AHTR6
SCHEMBL29674819 0.78 CDK6 (0.41) HTR6PIK3CDPIK3CBPIK3CGCSF1R
SCHEMBL17384723 0.77 ALDH1A1 (0.36) NPC1PKMPKLRRAB9AHTR6

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-2024130344-A1 TRANSIENT RECEPTOR POTENTIAL VANILLOID 6 INHIBITORS UNIQUEST PTY LIMITED (AU) 2024-06-27 WO disclosed