SCHEMBL4380609

SCHEMBL4380609

C=Cc1ncccc1OCC

nearest known ligand 0.45

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
GRM5 P41594 4/20 0.45
ALDH1A1 P00352 2/20 0.41
MAPT P10636 3/20 0.40
LMNA P02545 2/20 0.40
KDM4E B2RXH2 1/20 0.40
PDE5A O76074 1/20 0.40
KMT2A Q03164 3/20 0.39
MEN1 O00255 2/20 0.39
HTT P42858 2/20 0.38
L3MBTL1 Q9Y468 3/20 0.38
ALOX12 P18054 1/20 0.38
SYK P43405 1/20 0.37
NPSR1 Q6W5P4 2/20 0.37
HPGD P15428 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
GLA P06280 1/20 0.37
MAPK10 P53779 1/20 0.36
TTR P02766 1/20 0.36

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
SCHEMBL934218 0.81 GRM5 (0.45) GRM5ALDH1A1MAPTLMNAPDE5A
SCHEMBL4378934 0.81 NFE2L2 (0.51) GRM5ALDH1A1MAPTLMNAKDM4E
SCHEMBL3876256 0.79 PDE5A (0.43) ALDH1A1MAPTLMNAKDM4EPDE5A
SCHEMBL17300114 0.75 NPC1 (0.47) ALDH1A1MAPTLMNAKDM4EPDE5A
SCHEMBL16956202 0.74 ALDH1A1 (0.48) ALDH1A1MAPTLMNAKDM4EKMT2A
SCHEMBL6269386 0.74 NFE2L2 (0.33) MAPTLMNASMN1; SMN2
SCHEMBL14555898 0.74 CYP2D6 (0.44) ALDH1A1MAPTLMNAKDM4EKMT2A
SCHEMBL472968 0.73 LMNA (0.37) ALDH1A1MAPTLMNAKDM4EHTT
SCHEMBL31461865 0.72 ALDH1A1 (0.52) GRM5ALDH1A1LMNAPDE5AKMT2A
SCHEMBL13261314 0.72 GRM5 (0.50) GRM5ALDH1A1MAPTLMNAKDM4E

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-20090081696-A1 LUMINESCENCE ENHANCER AND USE THEREOF FUJIREBIO INC. (JP) 2009-03-26 US disclosed
EP-2028250-A1 LUMINESCENCE ENHANCER FUJIREBIO INC. (JP) 2009-02-25 EP disclosed