SCHEMBL8943737

SCHEMBL8943737

CCCCOc1ccc(Nc2ccc(Oc3ccc(Oc4ccc(Nc5ccc(OCCCC)cc5)cc4Nc4ccc(OCCCC)cc4)cc3)c(Nc3ccc(OCCCC)cc3)c2)cc1

nearest known ligand 0.46

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
LTA4H P09960 4/20 0.46
MAPT P10636 1/20 0.44
UNG P13051 2/20 0.43
ADAMTS5 Q9UNA0 2/20 0.43
NPC1 O15118 1/20 0.42
RAB9A P51151 1/20 0.42
GAA P10253 3/20 0.41
KDM4E B2RXH2 1/20 0.41
HPGD P15428 1/20 0.41
LMNA P02545 1/20 0.40
TSHR P16473 1/20 0.40
HTT P42858 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
MAPK1 P28482 2/20 0.39
PTGES O14684 1/20 0.39
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38

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
SCHEMBL8943853 0.96 UNG (0.49) LTA4HUNGNPC1RAB9AGAA
SCHEMBL8943895 0.92 UNG (0.46) LTA4HUNGNPC1RAB9AGAA
SCHEMBL8943755 0.81 ALDH1A1 (0.35) MAPTTSHRMAPK1PTGES
SCHEMBL49791 0.80 NPC1 (0.58) LTA4HMAPTUNGADAMTS5NPC1
SCHEMBL31151862 0.80 NPC1 (0.58) LTA4HMAPTUNGADAMTS5NPC1
SCHEMBL8943616 0.80 MAPT (0.59) MAPTNPC1RAB9AGAAKDM4E
SCHEMBL8943647 0.80 AKR1C3 (0.43) MAPTNPC1RAB9AGAAKDM4E
SCHEMBL8324472 0.77 NPC1 (0.64) LTA4HUNGADAMTS5NPC1RAB9A
SCHEMBL8962083 0.76 LMNA (0.58) MAPTUNGNPC1RAB9AGAA
SCHEMBL8944306 0.76 LTA4H (0.50) LTA4HADAMTS5NPC1RAB9A

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
US-5480765-A PRESSURE AND HEAT SENSITIVE PAPER, IMPROVED PHOTOSTABILITY BY ADDITION OF TRIARYLAMINE COMPOUND FUJI PHOTO FILM CO., LTD. (JP) 1996-01-02 US disclosed