SCHEMBL9803899

SCHEMBL9803899

OCCCOc1nc2ccccc2o1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LTA4H P09960 8/20 0.46
MAPT P10636 4/20 0.44
NPC1 O15118 3/20 0.44
RAB9A P51151 3/20 0.44
KCNH2 Q12809 1/20 0.44
TDP1 Q9NUW8 2/20 0.42
L3MBTL1 Q9Y468 2/20 0.42
MAPK1 P28482 1/20 0.42
TP53 P04637 4/20 0.41
SMN1; SMN2 Q16637 3/20 0.41
LMNA P02545 2/20 0.41
ALDH1A1 P00352 3/20 0.41
HSD17B10 Q99714 3/20 0.41
KMT2A Q03164 3/20 0.41
F2 P00734 1/20 0.41
MIF P14174 1/20 0.41
KDM4E B2RXH2 1/20 0.40
CYP1A2 P05177 1/20 0.40
CYP2C9 P11712 1/20 0.40
HPGD P15428 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
SCHEMBL6608244 0.94 LTA4H (0.44) LTA4HMAPTNPC1RAB9AKCNH2
SCHEMBL18013086 0.83 MAPT (0.53) LTA4HMAPTKCNH2TDP1L3MBTL1
SCHEMBL16726530 0.81 LOXL2 (0.53) LTA4HMAPTNPC1RAB9AKCNH2
SCHEMBL13481254 0.81 NPC1 (0.50) LTA4HMAPTNPC1RAB9AKCNH2
SCHEMBL10642084 0.81 ALDH1A1 (0.55) LTA4HMAPTNPC1RAB9ATDP1
SCHEMBL11547369 0.80 RAB9A (0.43) LTA4HMAPTNPC1RAB9AKCNH2
SCHEMBL9618163 0.78 CHRNB4 (0.49) LTA4HMAPTNPC1RAB9AKCNH2
SCHEMBL9165943 0.77 ELANE (0.61) LTA4HMAPTNPC1RAB9ATP53
SCHEMBL2539650 0.75 MEN1 (0.50) MAPTNPC1RAB9ATP53SMN1; SMN2
SCHEMBL10489374 0.75 RAB9A (0.45) MAPTNPC1RAB9AL3MBTL1MAPK1

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-5075300-A Hypoglycemic and antilipemic agents BEECHAM GROUP P.L.C. (GB) 1991-12-24 US disclosed
EP-0356214-A2 Thiazolidine dione derivatives BEECHAM GROUP PLC (GB) 1990-02-28 EP disclosed