SCHEMBL25588355

SCHEMBL25588355

COC(=O)C1CCN(c2ccccc2)CC(C)C1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NOTUM Q6P988 6/20 0.56
MAPT P10636 2/20 0.49
ALDH1A1 P00352 3/20 0.48
SMN1; SMN2 Q16637 2/20 0.45
NPC1 O15118 2/20 0.45
RAB9A P51151 2/20 0.45
HPGD P15428 1/20 0.45
NPSR1 Q6W5P4 1/20 0.45
HSD17B10 Q99714 1/20 0.45
USP30 Q70CQ3 1/20 0.44
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
GAA P10253 1/20 0.43
TSHR P16473 1/20 0.43
PDK2 Q15119 1/20 0.42
SLC6A4 P31645 2/20 0.42
ACACB O00763 1/20 0.41
LTA4H P09960 1/20 0.41
USP2 O75604 1/20 0.41
SLC6A2 P23975 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
SCHEMBL892980 0.87 NOTUM (0.69) NOTUMMAPTALDH1A1SMN1; SMN2NPC1
SCHEMBL24435477 0.87 NOTUM (0.69) NOTUMMAPTALDH1A1SMN1; SMN2NPC1
SCHEMBL1221442 0.84 MAPT (0.65) NOTUMMAPTALDH1A1SMN1; SMN2NPC1
SCHEMBL28087158 0.79 NOTUM (0.56) NOTUMMAPTALDH1A1SMN1; SMN2NPC1
SCHEMBL25603132 0.78 NOTUM (0.53) NOTUMMAPTALDH1A1SMN1; SMN2NPC1
SCHEMBL20046283 0.75 USP2 (0.57) NOTUMMAPTALDH1A1SMN1; SMN2HSD17B10
SCHEMBL20887690 0.74 MAPT (0.57) NOTUMMAPTALDH1A1SMN1; SMN2HSD17B10
SCHEMBL19904630 0.74 MAPT (0.57) NOTUMMAPTALDH1A1SMN1; SMN2HSD17B10
SCHEMBL22434593 0.74 MAPT (0.57) NOTUMMAPTALDH1A1SMN1; SMN2HSD17B10
SCHEMBL20887605 0.74 MAPT (0.57) NOTUMMAPTALDH1A1SMN1; SMN2HSD17B10

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-2023107547-A2 AZETIDINE AND SPIROAZETIDINE COMPOUNDS AND USES THEREOF Kineta, Inc. (US) 2023-06-15 WO disclosed