SCHEMBL25810273

SCHEMBL25810273

CC1CCN(c2ccc3cc(C(=O)O)sc3c2)CC1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
USP2 O75604 1/20 0.54
SMN1; SMN2 Q16637 3/20 0.47
NPC1 O15118 2/20 0.47
RAB9A P51151 2/20 0.47
MITF O75030 1/20 0.47
TP53 P04637 1/20 0.47
NFKB1 P19838 1/20 0.47
NFKB2 Q00653 1/20 0.47
RELA Q04206 1/20 0.47
CHRNA7 P36544 1/20 0.44
BCL2L1 Q07817 1/20 0.44
MAPT P10636 2/20 0.42
NR1H4 Q96RI1 2/20 0.42
KDM4E B2RXH2 1/20 0.41
POLB P06746 1/20 0.41
GAA P10253 1/20 0.41
NR4A1 P22736 1/20 0.41
HSD17B10 Q99714 1/20 0.41
RPA1 P27694 5/20 0.41
GPR35 Q9HC97 1/20 0.41

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
SCHEMBL30492862 1.00 USP2 (0.54) USP2SMN1; SMN2NPC1RAB9AMITF
SCHEMBL30492883 0.86 CHRNA7 (0.42) USP2CHRNA7BCL2L1NR1H4RPA1
SCHEMBL25810758 0.86 CHRNA7 (0.42) USP2CHRNA7BCL2L1NR1H4RPA1
SCHEMBL31025961 0.84 HRH4 (0.49) SMN1; SMN2NPC1RAB9ACHRNA7BCL2L1
SCHEMBL25296879 0.84 HRH4 (0.49) SMN1; SMN2NPC1RAB9ACHRNA7BCL2L1
SCHEMBL17858475 0.83 IP6K1 (0.50) SMN1; SMN2NPC1RAB9ATP53CHRNA7
SCHEMBL30492838 0.83 LGMN (0.47) USP2SMN1; SMN2NPC1RAB9ACHRNA7
SCHEMBL25810272 0.83 LGMN (0.47) USP2SMN1; SMN2NPC1RAB9ACHRNA7
SCHEMBL30492925 0.83 CHRNA7 (0.46) CHRNA7BCL2L1MAPTNR1H4KDM4E
SCHEMBL25809845 0.83 CHRNA7 (0.46) CHRNA7BCL2L1MAPTNR1H4KDM4E

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-2023125376-A1 FUSED BICYCLIC HETEROARYL AMIDE COMPOUND AS PROTEIN AGGREGATION INHIBITOR 上海京新生物医药有限公司 2023-07-06 WO disclosed