SCHEMBL26517033

SCHEMBL26517033

COC(=O)N1CC(C)Cc2ccccc21

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NOTUM Q6P988 3/20 0.49
MEN1 O00255 1/20 0.47
KMT2A Q03164 1/20 0.47
ALDH1A1 P00352 2/20 0.45
TSHR P16473 2/20 0.45
MAPT P10636 2/20 0.45
LMNA P02545 1/20 0.45
HPGD P15428 1/20 0.45
HSD17B10 Q99714 1/20 0.45
L3MBTL1 Q9Y468 1/20 0.45
KDM4E B2RXH2 2/20 0.42
GAA P10253 1/20 0.42
MTNR1A P48039 3/20 0.41
MTNR1B P49286 3/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
P2RX4 Q99571 1/20 0.41
MCL1 Q07820 1/20 0.40
NPC1 O15118 1/20 0.40
PKM P14618 1/20 0.40
NFKB1 P19838 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
SCHEMBL16353667 0.85 NOTUM (0.47) NOTUMSMN1; SMN2
SCHEMBL6648174 0.85 NOTUM (0.47) NOTUMSMN1; SMN2
SCHEMBL16385108 0.85 NOTUM (0.47) NOTUMSMN1; SMN2
SCHEMBL16353535 0.85 NOTUM (0.47) NOTUMSMN1; SMN2
SCHEMBL21172497 0.83 NOTUM (0.61) NOTUMLMNAMTNR1AMTNR1BSMN1; SMN2
SCHEMBL21172644 0.83 NOTUM (0.61) NOTUMLMNAMTNR1AMTNR1BSMN1; SMN2
SCHEMBL26517034 0.81 NOTUM (0.51) NOTUMALDH1A1TSHRMTNR1AMTNR1B
SCHEMBL23917172 0.81 KDM4E (0.59) NOTUMMEN1KMT2AALDH1A1TSHR
SCHEMBL17619538 0.81 NPC1 (0.62) NOTUML3MBTL1GAAMTNR1AMTNR1B
SCHEMBL21172618 0.79 NOTUM (0.49) NOTUMALDH1A1TSHRLMNAKDM4E

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-2023192375-A1 HSD17B13 INHIBITORS AND USES THEREOF FL2022-001, INC. (US) 2023-10-05 WO disclosed