SCHEMBL25793602

SCHEMBL25793602

CCC(C)(C)OC(=O)N1CCC2(CCO2)CC1

nearest known ligand 0.41

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
USP2 O75604 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
MGLL Q99685 9/20 0.40
NAMPT P43490 1/20 0.38
TSHR P16473 1/20 0.36
RECQL P46063 2/20 0.35
GPR119 Q8TDV5 2/20 0.34
KMT2A Q03164 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
SCHEMBL18053621 0.84 USP2 (0.59) USP2SMN1; SMN2MGLLTSHRRECQL
SCHEMBL1855329 0.80 SMN1; SMN2 (0.46) USP2SMN1; SMN2NAMPTTSHRRECQL
SCHEMBL14802585 0.79 SMN1; SMN2 (0.66) USP2SMN1; SMN2TSHRRECQL
SCHEMBL4278413 0.77 USP2 (0.54) USP2SMN1; SMN2MGLLTSHRRECQL
SCHEMBL30267043 0.77 USP2 (0.41) USP2SMN1; SMN2NAMPTTSHRGPR119
SCHEMBL1848025 0.77 HPGD (0.47) USP2SMN1; SMN2TSHRKMT2A
SCHEMBL15166534 0.76 KMT2A (0.39) USP2SMN1; SMN2NAMPTGPR119KMT2A
SCHEMBL879545 0.75 HPGD (0.50) USP2SMN1; SMN2KMT2A
SCHEMBL2960741 0.75 USP2 (0.51) USP2SMN1; SMN2MGLLNAMPTRECQL
SCHEMBL15160794 0.74 HTR1A (0.43) USP2SMN1; SMN2MGLLTSHRRECQL

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-2023130054-A2 HETEROARYL COMPOUNDS AS INHIBITORS OF IRAK4, COMPOSITIONS AND APPLICATIONS THEREOF ACCRO BIOSCIENCE (HK) LIMITED (CN) 2023-07-06 WO disclosed