SCHEMBL9557282

SCHEMBL9557282

c1ccc(Sc2ccccc2Oc2ccccc2Sc2ccccc2)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.47
KDM4E B2RXH2 2/20 0.47
MAPK1 P28482 2/20 0.47
NSD2 O96028 1/20 0.47
SLC6A9 P48067 2/20 0.44
SIRT1 Q96EB6 1/20 0.44
TDP1 Q9NUW8 3/20 0.43
SMN1; SMN2 Q16637 2/20 0.43
NPY1R P25929 1/20 0.43
NPY2R P49146 1/20 0.43
L3MBTL1 Q9Y468 4/20 0.41
ALDH1A1 P00352 3/20 0.41
GLA P06280 1/20 0.41
KMT2A Q03164 2/20 0.41
MEN1 O00255 1/20 0.41
BLM P54132 1/20 0.41
HPGD P15428 2/20 0.40
LMNA P02545 1/20 0.40
ATM Q13315 1/20 0.40
TUBB4A P04350 1/20 0.39

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
SCHEMBL14654309 0.89 TSHR (0.44) MAPTKDM4EMAPK1NSD2SLC6A9
SCHEMBL16682061 0.88 L3MBTL1 (0.45) MAPTKDM4EMAPK1NSD2SLC6A9
SCHEMBL3289071 0.82 AR (0.56) MAPTKDM4EMAPK1NSD2SLC6A9
SCHEMBL7876076 0.81 NCOA1 (0.53) MAPTKDM4EMAPK1NSD2SIRT1
SCHEMBL9557543 0.81 KDM4E (0.41) MAPTKDM4EMAPK1NSD2SLC6A9
SCHEMBL795029 0.79 SIRT1 (0.54) MAPTKDM4EMAPK1NSD2SIRT1
SCHEMBL11060851 0.79 SIRT1 (0.47) MAPTKDM4EMAPK1NSD2SLC6A9
Water SCHEMBL11132055 0.79 KDM4E (0.42) MAPTKDM4EMAPK1NSD2SLC6A9
SCHEMBL30580493 0.78 SLC6A9 (0.46) MAPK1SLC6A9TDP1L3MBTL1ALDH1A1
SCHEMBL9780318 0.77 MAOB (0.56) MAPTKDM4EMAPK1NSD2SIRT1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5271858-A Field dependent fluids containing electrically conductive tin oxide coated materials ENSCI INC. (US) 1993-12-21 US disclosed
US-3939084-A Functional fluid compositions containing substituted pyrimidines MONSANTO COMPANY (US) 1976-02-17 US disclosed