SCHEMBL21242228

SCHEMBL21242228

Oc1ccc(/N=N/c2ccc(-c3ccc(-c4ccc(NNc5ccc(O)cc5)cc4)cc3)cc2)cc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.53
NPC1 O15118 3/20 0.53
LMNA P02545 3/20 0.53
RAB9A P51151 2/20 0.53
HPGD P15428 1/20 0.53
NFKB1 P19838 1/20 0.53
NFKB2 Q00653 1/20 0.53
RELA Q04206 1/20 0.53
MEN1 O00255 3/20 0.52
KMT2A Q03164 3/20 0.52
GLB1 P16278 1/20 0.50
CTRB1 P17538 1/20 0.50
CTRC Q99895 1/20 0.50
ESR1 P03372 2/20 0.48
ESR2 Q92731 1/20 0.48
EGFR P00533 1/20 0.44
HTT P42858 2/20 0.44
CA12 O43570 1/20 0.42
CA2 P00918 1/20 0.42
CA7 P43166 1/20 0.42

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
SCHEMBL12534430 0.86 NPC1 (0.67) MAPTNPC1LMNARAB9AHPGD
SCHEMBL21242225 0.86 NPC1 (0.67) MAPTNPC1LMNARAB9AHPGD
SCHEMBL1998504 0.78 ALDH1A1 (0.57) MAPTNPC1LMNARAB9AHPGD
SCHEMBL901189 0.78 NPC1 (0.78) MAPTNPC1LMNARAB9AHPGD
SCHEMBL901190 0.78 NPC1 (0.78) MAPTNPC1LMNARAB9AHPGD
SCHEMBL9367894 0.78 NPC1 (0.78) MAPTNPC1LMNARAB9AHPGD
SCHEMBL9367899 0.78 NPC1 (0.78) MAPTNPC1LMNARAB9AHPGD
SCHEMBL19227699 0.77 MAPT (0.90) MAPTNPC1LMNARAB9AHPGD
SCHEMBL3464588 0.77 MEN1 (0.86) MAPTNPC1LMNARAB9ANFKB1
SCHEMBL19227700 0.76 LMNA (0.57) MAPTNPC1LMNARAB9AHPGD

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
EP-3412734-B1 DYE COMPOUND, COMPOSITION COMPRISING THE DYE COMPOUND, AND DISPLAY DEVICE USING THE DYE COMPOUND SAMSUNG DISPLAY CO LTD (KR) 2019-08-07 EP disclosed