SCHEMBL6003605

SCHEMBL6003605

Nc1onnc1-c1ccccc1-c1nnoc1N

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
TDO2 P48775 3/20 0.36
LMNA P02545 1/20 0.35
KDM4E B2RXH2 3/20 0.32
SMN1; SMN2 Q16637 4/20 0.32
NPC1 O15118 3/20 0.32
RAB9A P51151 3/20 0.32
HPGD P15428 2/20 0.32
GAA P10253 1/20 0.32
CYP1A2 P05177 1/20 0.31
CYP2D6 P10635 1/20 0.31
ADORA2A P29274 2/20 0.31
ADORA1 P30542 2/20 0.31
ATAD2 Q6PL18 1/20 0.31
BRD4 O60885 1/20 0.31
IDO1 P14902 1/20 0.31
TP53 P04637 1/20 0.30
CASP3 P42574 1/20 0.30
SENP8 Q96LD8 1/20 0.30

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
SCHEMBL5152914 0.80 ADORA2A (0.45) ALDH1A1L3MBTL1TDO2LMNAKDM4E
SCHEMBL8754426 0.79 NPC1 (0.31) ALDH1A1L3MBTL1SMN1; SMN2NPC1RAB9A
SCHEMBL6003961 0.77
SCHEMBL6003603 0.73 ALDH1A1 (0.40) ALDH1A1L3MBTL1TDO2KDM4ESMN1; SMN2
SCHEMBL12237786 0.71 ALDH1A1 (0.50) ALDH1A1L3MBTL1KDM4ESMN1; SMN2NPC1
SCHEMBL9176881 0.67 ALDH1A1 (0.48) ALDH1A1L3MBTL1TDO2KDM4ESMN1; SMN2
SCHEMBL2200421 0.67 GPR55 (0.42) ALDH1A1TDO2SMN1; SMN2NPC1RAB9A
SCHEMBL2200423 0.67 GPR55 (0.42) ALDH1A1L3MBTL1TDO2LMNAKDM4E
SCHEMBL11673806 0.63 RAB9A (0.47) ALDH1A1LMNAKDM4ESMN1; SMN2NPC1
SCHEMBL9435387 0.61 PTGS1 (0.35) L3MBTL1SMN1; SMN2NPC1RAB9ABRD4

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7092608-B2 Polyimide optical materials, polyimide precursor solutions and optical waveguide elements KABUSHIKI KAISHA TOSHIBA (JP) 2006-08-15 US claimed
US-20060159413-A1 POLYIMIDE OPTICAL MATERIALS, POLYIMIDE PRECURSOR SOLUTIONS AND OPTICAL WAVEGUIDE ELEMENTS KABUSHIKI KAISHA TOSHIBA (JP) 2006-07-20 US claimed
US-7092608-B2 Polyimide optical materials, polyimide precursor solutions and optical waveguide elements KABUSHIKI KAISHA TOSHIBA (JP) 2006-08-15 US disclosed
US-7082244-B2 Polyimide optical materials, polyimide precursor solutions and optical waveguide elements KABUSHIKI KAISHA TOSHIBA (JP) 2006-07-25 US disclosed
US-20060159413-A1 POLYIMIDE OPTICAL MATERIALS, POLYIMIDE PRECURSOR SOLUTIONS AND OPTICAL WAVEGUIDE ELEMENTS KABUSHIKI KAISHA TOSHIBA (JP) 2006-07-20 US disclosed
US-20040197064-A1 Polyimide optical materials, polyimide precursor solutions and optical waveguide elements KABUSHIKI KAISHA TOSHIBA (JP) 2004-10-07 US disclosed