SCHEMBL20059520

SCHEMBL20059520

COC(=O)N1c2ccccc2C[C@H]1C

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NOTUM Q6P988 1/20 0.69
ALDH1A1 P00352 8/20 0.64
MAPT P10636 3/20 0.64
TSHR P16473 2/20 0.64
LMNA P02545 2/20 0.64
HPGD P15428 1/20 0.64
HSD17B10 Q99714 1/20 0.64
L3MBTL1 Q9Y468 1/20 0.64
MCL1 Q07820 1/20 0.58
PKM P14618 2/20 0.57
SMN1; SMN2 Q16637 3/20 0.55
NPC1 O15118 2/20 0.55
RAB9A P51151 1/20 0.55
CYP1A2 P05177 1/20 0.55
CYP2C19 P33261 1/20 0.55
POLB P06746 1/20 0.54
SLC22A12 Q96S37 1/20 0.53
MEN1 O00255 1/20 0.53
KMT2A Q03164 1/20 0.53
ALOX15 P16050 1/20 0.52

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
SCHEMBL29923052 1.00 NOTUM (0.69) NOTUMALDH1A1MAPTTSHRLMNA
SCHEMBL13108813 0.84 NOTUM (0.65) NOTUMALDH1A1MAPTTSHRLMNA
SCHEMBL15746086 0.84 NOTUM (0.65) NOTUMALDH1A1MAPTTSHRLMNA
SCHEMBL15187564 0.84 NOTUM (0.65) NOTUMALDH1A1MAPTTSHRLMNA
SCHEMBL9470723 0.84 MEN1 (0.60) NOTUMALDH1A1MAPTTSHRLMNA
SCHEMBL29571656 0.84 NOTUM (0.65) NOTUMALDH1A1MAPTTSHRLMNA
SCHEMBL17452555 0.84 NOTUM (0.65) NOTUMALDH1A1MAPTTSHRLMNA
SCHEMBL22262462 0.83 NOTUM (0.51) NOTUMALDH1A1MAPTTSHRLMNA
SCHEMBL22262464 0.83 NOTUM (0.51) NOTUMALDH1A1MAPTTSHRLMNA
SCHEMBL29660034 0.83 NOTUM (0.51) NOTUMALDH1A1MAPTTSHRLMNA

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
EP-3100745-B1 NOVEL BENZODIAZEPINE DERIVATIVES IMMUNOGEN INC (US) 2018-04-18 EP disclosed