SCHEMBL24638293

SCHEMBL24638293

Cc1cc(B2OC(C)(C)C(C)(C)O2)ccc1NCC(C)NC(=O)OC(C)(C)C

nearest known ligand 0.50

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
AAK1 Q2M2I8 4/20 0.50
PRMT5 O14744 1/20 0.44
WDR77 Q9BQA1 1/20 0.44
HIF1A Q16665 5/20 0.40
POLB P06746 1/20 0.37
ATM Q13315 1/20 0.37
BACE1 P56817 1/20 0.36
BACE2 Q9Y5Z0 1/20 0.36
DGAT1 O75907 1/20 0.36
USP30 Q70CQ3 2/20 0.35
MAPT P10636 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
CA1 P00915 1/20 0.33
CA2 P00918 1/20 0.33
CA9 Q16790 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
SCHEMBL65546 0.81 AAK1 (0.53) AAK1PRMT5WDR77HIF1APOLB
SCHEMBL22664660 0.80 AAK1 (0.52) AAK1PRMT5WDR77HIF1APOLB
SCHEMBL16813062 0.80 AAK1 (0.52) AAK1PRMT5WDR77HIF1APOLB
SCHEMBL29418593 0.80 AAK1 (0.52) AAK1PRMT5WDR77HIF1APOLB
SCHEMBL30048971 0.79 AAK1 (0.55) AAK1POLBATMMAPTSMN1; SMN2
SCHEMBL2428565 0.77 LPL (0.39) AAK1HIF1ACA1CA2CA9
SCHEMBL2592447 0.77 AAK1 (0.55) AAK1PRMT5WDR77ATMDGAT1
SCHEMBL19980304 0.77 AAK1 (0.45) AAK1PRMT5WDR77HIF1ABACE1
SCHEMBL16491250 0.75 AAK1 (0.64) AAK1PRMT5WDR77HIF1ADGAT1
SCHEMBL16491251 0.75 AAK1 (0.64) AAK1PRMT5WDR77HIF1ADGAT1

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-2022231242-A1 INDAZOLE COMPOUND HAVING LRRK2 INHIBITORY ACTIVITY 주식회사 스탠다임 2022-11-03 WO disclosed