SCHEMBL29946293

SCHEMBL29946293

O=C(O)CN1CC2CCC(C1)O2

nearest known ligand 0.46

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PIK3CD O00329 1/20 0.45
HSD17B10 Q99714 1/20 0.42
WNT1 P04628 1/20 0.31
GSK3B P49841 1/20 0.31
DYRK1A Q13627 1/20 0.31
ACE P12821 1/20 0.31

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
SCHEMBL9208423 0.90 HSD17B10 (0.47) PIK3CDHSD17B10ACE
Trifluoroacetic Acid SCHEMBL28956754 0.89 PIK3CD (0.38) PIK3CDHSD17B10
SCHEMBL29946381 0.89 HSD17B10 (0.43) PIK3CDHSD17B10
Trifluoroacetic Acid SCHEMBL28864675 0.79 HSD17B10 (0.36) HSD17B10
SCHEMBL7289985 0.74 POLB (0.49) HSD17B10
SCHEMBL1701604 0.74 POLB (0.49) HSD17B10
SCHEMBL8406208 0.74 POLB (0.49) HSD17B10
SCHEMBL15438887 0.74 POLB (0.49) HSD17B10
SCHEMBL15447586 0.74 POLB (0.49) HSD17B10
Hydrochloric Acid SCHEMBL1375057 0.72 POLB (0.48) HSD17B10

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-115244047-A Indazole derivative and application thereof in medicine 四川海思科制药有限公司 2022-10-25 CN disclosed