SCHEMBL11514575

SCHEMBL11514575

Cc1ccc(OC(=O)c2ccc(C=Cc3nc4ccccc4o3)cc2)cc1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 4/20 0.57
RAB9A P51151 4/20 0.57
MEN1 O00255 3/20 0.57
KMT2A Q03164 3/20 0.57
KDM4E B2RXH2 2/20 0.53
ALDH1A1 P00352 2/20 0.53
HPGD P15428 2/20 0.53
CYP2D6 P10635 1/20 0.53
ATP4A P20648 14/20 0.51
ATP4B P51164 14/20 0.51
MAPT P10636 2/20 0.49
HTT P42858 1/20 0.49
SMN1; SMN2 Q16637 1/20 0.49
HDAC3 O15379 1/20 0.49
HDAC4 P56524 1/20 0.49
HDAC1 Q13547 1/20 0.49
HDAC7 Q8WUI4 1/20 0.49
HDAC2 Q92769 1/20 0.49
HDAC10 Q969S8 1/20 0.49
HDAC11 Q96DB2 1/20 0.49

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
SCHEMBL11514566 1.00 NPC1 (0.57) NPC1RAB9AMEN1KMT2AKDM4E
SCHEMBL4826178 0.84 RAB9A (0.66) NPC1RAB9AMEN1KMT2AKDM4E
SCHEMBL4826174 0.84 RAB9A (0.66) NPC1RAB9AMEN1KMT2AKDM4E
SCHEMBL708951 0.84 NPC1 (0.63) NPC1RAB9AMEN1KMT2AKDM4E
SCHEMBL708950 0.84 NPC1 (0.63) NPC1RAB9AMEN1KMT2AKDM4E
SCHEMBL25491830 0.80 KMT2A (0.61) RAB9AMEN1KMT2AKDM4EMAPT
SCHEMBL317883 0.79 MEN1 (0.64) NPC1RAB9AMEN1KMT2AKDM4E
SCHEMBL710009 0.79 MEN1 (0.64) NPC1RAB9AMEN1KMT2AKDM4E
SCHEMBL12956185 0.78 NPC1 (0.67) NPC1RAB9AMEN1KMT2AATP4A
SCHEMBL11514571 0.77 MAPT (0.50) NPC1RAB9AMEN1KMT2AKDM4E

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-4162254-A Benzoxazole ultraviolet stabilizers EASTMAN KODAK COMPANY (US) 1979-07-24 US disclosed
US-4096115-A Ultraviolet light stabilized polymers EASTMAN KODAK COMPANY (US) 1978-06-20 US disclosed