SCHEMBL24670979

SCHEMBL24670979

CC(N)[C@@H](C)N1CCN(C(=O)OC(C)(C)C)CC1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
USP2 O75604 1/20 0.49
SMN1; SMN2 Q16637 1/20 0.49
HTT P42858 2/20 0.44
ATM Q13315 1/20 0.44
ALDH1A1 P00352 2/20 0.43
MAPT P10636 2/20 0.43
NPC1 O15118 1/20 0.43
MAPK1 P28482 1/20 0.43
RAB9A P51151 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
HRH3 Q9Y5N1 1/20 0.42
HPGD P15428 1/20 0.42
EPHX2 P34913 1/20 0.41
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
RECQL P46063 1/20 0.40
EPHX1 P07099 1/20 0.40
DPP4 P27487 1/20 0.40
LMNA P02545 1/20 0.40
POLB P06746 1/20 0.38

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
SCHEMBL3565907 0.86 USP2 (0.51) USP2SMN1; SMN2HTTATMALDH1A1
SCHEMBL27365987 0.85 USP2 (0.50) USP2SMN1; SMN2HTTATMALDH1A1
SCHEMBL25524991 0.84 USP2 (0.46) USP2SMN1; SMN2HTTATMALDH1A1
SCHEMBL2737190 0.82 HRH3 (0.58) USP2SMN1; SMN2HTTATMALDH1A1
SCHEMBL29162701 0.82 USP2 (0.47) USP2SMN1; SMN2HTTATMALDH1A1
SCHEMBL20847001 0.82 USP2 (0.47) USP2SMN1; SMN2HTTATMALDH1A1
SCHEMBL5599546 0.81 USP2 (0.53) USP2SMN1; SMN2HTTATMALDH1A1
SCHEMBL19297036 0.81 USP2 (0.46) USP2SMN1; SMN2HTTATMALDH1A1
SCHEMBL22994977 0.81 USP2 (0.46) USP2SMN1; SMN2HTTATMALDH1A1
SCHEMBL25524072 0.80 USP2 (0.43) USP2SMN1; SMN2HTTATMALDH1A1

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-2022192162-A1 NOVEL HETEROAROMATIC COMPOUNDS EXHIBITING ANTIFUNGAL ACTIVITY AND THEIR METHOD OF USE FOX CHASE CHEMICAL DIVERSITY CENTER, INC. (US) 2022-09-15 WO disclosed