SCHEMBL31189134

SCHEMBL31189134

CC(C)(C)OC(=O)N1CCC2(CC1)CC(=O)C(=O)O2

nearest known ligand 0.47

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
USP2 O75604 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
KMT2A Q03164 1/20 0.44
GPR119 Q8TDV5 5/20 0.42
TSHR P16473 2/20 0.40
ALOX15 P16050 1/20 0.40
ATM Q13315 1/20 0.40
TACR1 P25103 1/20 0.40
CHRM2 P08172 1/20 0.40
CHRM4 P08173 1/20 0.40
CHRM1 P11229 1/20 0.40
CHRM3 P20309 1/20 0.40
RECQL P46063 1/20 0.40

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
SCHEMBL15166535 0.87 USP2 (0.44) USP2SMN1; SMN2KMT2AGPR119TSHR
SCHEMBL21273181 0.82 USP2 (0.40) USP2SMN1; SMN2GPR119TSHRALOX15
SCHEMBL19852497 0.82 HRH3 (0.53) KMT2AGPR119TSHRALOX15ATM
SCHEMBL21273179 0.82 USP2 (0.40) USP2SMN1; SMN2GPR119TSHRALOX15
SCHEMBL467280 0.82 ATM (0.56) KMT2AGPR119ATM
SCHEMBL3702583 0.82 ATM (0.56) KMT2AGPR119ATM
SCHEMBL21273182 0.82 USP2 (0.40) USP2SMN1; SMN2GPR119TSHRALOX15
SCHEMBL22911795 0.82 USP2 (0.44) USP2SMN1; SMN2KMT2AGPR119TSHR
SCHEMBL3493829 0.82 GPR119 (0.44) USP2SMN1; SMN2KMT2AGPR119TSHR
SCHEMBL4265096 0.81 KMT2A (0.55) SMN1; SMN2KMT2AGPR119

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-118638118-A Preparation method of 8-methyl-2, 8-diazaspiro [4.5] decane hydrochloride 南京合巨药业有限公司 2024-09-13 CN disclosed