SCHEMBL15871124

SCHEMBL15871124

CC(C)COc1ccc(-c2c3c(c(-c4ccc(OCC(C)C)cc4)c4nn(CC(C)C)nc24)NNN3)cc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 3/20 0.39
▸ NPC1 O15118 3/20 0.39
▸ RAB9A P51151 3/20 0.39
▸ TP53 P04637 2/20 0.39
▸ SMN1; SMN2 Q16637 2/20 0.39
▸ GAA P10253 1/20 0.39
▸ HTT P42858 1/20 0.39
▸ KDM4E B2RXH2 3/20 0.39
▸ ALDH1A1 P00352 3/20 0.39
▸ HPGD P15428 3/20 0.39
▸ POLB P06746 1/20 0.39
▸ CYP2C9 P11712 1/20 0.39
▸ CYP2C19 P33261 1/20 0.39
▸ LMNA P02545 2/20 0.39
▸ TSHR P16473 2/20 0.39
▸ HSD17B10 Q99714 2/20 0.39
▸ XDH P47989 1/20 0.38
▸ MEN1 O00255 1/20 0.37
▸ KMT2A Q03164 1/20 0.37
▸ MDM2 Q00987 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
SCHEMBL17281139 0.83 XDH (0.42) MAPTNPC1RAB9ATP53SMN1; SMN2
SCHEMBL15871117 0.78 NPC1 (0.39) MAPTNPC1RAB9ATP53SMN1; SMN2
SCHEMBL14799791 0.78 KDM4E (0.44) MAPTNPC1RAB9ATP53SMN1; SMN2
SCHEMBL15871067 0.77 NPSR1 (0.39) MAPTNPC1RAB9ATP53SMN1; SMN2
SCHEMBL17281141 0.77 MEN1 (0.47) MAPTNPC1RAB9ATP53SMN1; SMN2
SCHEMBL15871087 0.73 LMNA (0.37) MAPTNPC1RAB9ATP53SMN1; SMN2
SCHEMBL15871066 0.72 NPSR1 (0.36) MAPTNPC1RAB9ATP53SMN1; SMN2
SCHEMBL28527296 0.72 MEN1 (0.42) MAPTNPC1RAB9ATP53SMN1; SMN2
SCHEMBL15871070 0.72 MEN1 (0.43) MAPTNPC1RAB9ATP53KDM4E
SCHEMBL16402077 0.68 MEN1 (0.39) MAPTNPC1RAB9AKDM4EALDH1A1

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
WO-2014107606-A2 HIGHLY-FLUORESCENT AND PHOTO-STABLE CHROMOPHORES FOR WAVELENGTH CONVERSION NITTO DENKO CORPORATION (JP) 2014-07-10 — — WO disclosed
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