SCHEMBL9216484

SCHEMBL9216484

COC=C(C(=O)O)c1c(C)sc2ccccc12

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.46
MAPK1 P28482 1/20 0.46
CNR2 P34972 7/20 0.39
CNR1 P21554 5/20 0.39
L3MBTL1 Q9Y468 4/20 0.39
TDP1 Q9NUW8 4/20 0.39
ATM Q13315 2/20 0.39
KDM4E B2RXH2 3/20 0.38
ALDH1A1 P00352 3/20 0.38
HPGD P15428 2/20 0.38
MAPT P10636 2/20 0.38
MEN1 O00255 1/20 0.38
GLA P06280 1/20 0.38
GAA P10253 1/20 0.38
ALOX15 P16050 1/20 0.38
KMT2A Q03164 1/20 0.38
HSD17B10 Q99714 1/20 0.38
NPC1 O15118 2/20 0.38
PRNP P04156 1/20 0.37
RXFP1 Q9HBX9 1/20 0.37

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
SCHEMBL9212799 0.87 LMNA (0.48) LMNAMAPK1CNR2CNR1L3MBTL1
SCHEMBL9220169 0.83 LMNA (0.43) LMNAMAPK1CNR2CNR1L3MBTL1
SCHEMBL6840468 0.82 LMNA (0.41) LMNAMAPK1CNR2CNR1L3MBTL1
SCHEMBL6840465 0.82 LMNA (0.41) LMNAMAPK1CNR2CNR1L3MBTL1
SCHEMBL9220387 0.81 CNR2 (0.43) LMNAMAPK1CNR2CNR1L3MBTL1
SCHEMBL9756955 0.77 LMNA (0.46) LMNAMAPK1CNR2CNR1L3MBTL1
SCHEMBL9756952 0.77 LMNA (0.46) LMNAMAPK1CNR2CNR1L3MBTL1
SCHEMBL29448323 0.76 PRNP (0.53) LMNAMAPK1CNR2CNR1L3MBTL1
SCHEMBL1398747 0.76 PRNP (0.53) LMNAMAPK1CNR2CNR1L3MBTL1
SCHEMBL3599532 0.75 LMNA (0.71) LMNAMAPK1CNR2CNR1L3MBTL1

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-0433233-B1 Heterocyclic compounds CIBA GEIGY AG (CH) 1995-01-25 EP claimed