SCHEMBL6527260

SCHEMBL6527260

c1ccc(C2=C(c3ccccc3)/C3=N/C4=N/C(=N\C5=N/C(=N\C6=N/C(=N\C2=N3)C(c2ccccc2)=C6c2ccccc2)C(c2ccccc2)=C5c2ccccc2)C(c2ccccc2)=C4c2ccccc2)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.47
RAB9A P51151 4/20 0.43
NPC1 O15118 3/20 0.43
MAPK1 P28482 2/20 0.43
NOTUM Q6P988 1/20 0.41
KMT2A Q03164 3/20 0.39
MEN1 O00255 1/20 0.39
SMN1; SMN2 Q16637 2/20 0.38
ATM Q13315 1/20 0.38
ALOX15 P16050 1/20 0.38
PDE4B Q07343 1/20 0.37
NFKB1 P19838 1/20 0.36
NFKB2 Q00653 1/20 0.36
RELA Q04206 1/20 0.36
CYP1A2 P05177 1/20 0.35
LMNA P02545 1/20 0.35
MAPT P10636 1/20 0.35
HTT P42858 1/20 0.35
CYP3A4 P08684 1/20 0.35
TAAR1 Q96RJ0 1/20 0.35

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
SCHEMBL6412996 0.97 ALDH1A1 (0.44) ALDH1A1RAB9ANPC1MAPK1NOTUM
SCHEMBL21151453 0.80 ALDH1A1 (0.53) ALDH1A1RAB9ANPC1MAPK1NOTUM
SCHEMBL852224 0.75 ALDH1A1 (0.67) ALDH1A1RAB9ANPC1MAPK1NOTUM
SCHEMBL532969 0.75 ALDH1A1 (0.67) ALDH1A1RAB9ANPC1MAPK1NOTUM
SCHEMBL532970 0.75 ALDH1A1 (0.67) ALDH1A1RAB9ANPC1MAPK1NOTUM
SCHEMBL8980173 0.72 ALDH1A1 (0.61) ALDH1A1RAB9ANPC1MAPK1NOTUM
SCHEMBL8440556 0.72 ALDH1A1 (0.61) ALDH1A1RAB9ANPC1MAPK1NOTUM
SCHEMBL31290735 0.72 ALDH1A1 (0.61) ALDH1A1RAB9ANPC1MAPK1NOTUM
SCHEMBL12997586 0.69 ALDH1A1 (0.47) ALDH1A1RAB9ANPC1MAPK1NOTUM
Biphenyl SCHEMBL164 0.67 ALDH1A1 (1.00) ALDH1A1RAB9ANPC1MAPK1NOTUM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1585977-A Writable high-capacity optical storage media containing metal complexes CIBA SC HOLDING AG (CH) 2005-02-23 CN disclosed
US-20050008974-A1 Writable high-capacity optical storage media containing metal complexes CIBA SPECIALTY CHEMICALS CORP. 2005-01-13 US disclosed
EP-1446800-A1 WRITABLE HIGH-CAPACITY OPTICAL STORAGE MEDIA CONTAINING METAL COMPLEXES Ciba SC Holding AG (CH) 2004-08-18 EP disclosed
WO-2003042990-A1 WRITABLE HIGH-CAPACITY OPTICAL STORAGE MEDIA CONTAINING METAL COMPLEXES CIBA SPECIALTY CHEMICALS HOLDINGS INC. (CH) 2003-05-22 WO disclosed
JP-2002012791-A OCTAPHENYLTETRAAZAPORPHYRIN, METHOD OF MANUFACTURING THE SAME, ELECTROPHOTOGRAPHIC PHOTOCONDUCTOR, PROCESS CARTRIDGE AND ELECTROPHOTOGRAPHIC EQUIPMENT USING THE SAME CANON INC 2002-01-15 JP disclosed
US-4271262-A Photoimaging process which uses sulfide containing polymeric films MONSANTO COMPANY (US) 1981-06-02 US disclosed
US-4266004-A Photoimageable material of polymeric material having organic sulfide and photo-oxidation sensitizer MONSANTO COMPANY (US) 1981-05-05 US disclosed
US-4234674-A Amino-functional photopolymer compositions and photo-oxidation imaging processes employing same MONSANTO COMPANY (US) 1980-11-18 US disclosed
US-4188223-A Amino-functional photopolymer compositions and photo-oxidation imaging processes employing same MONSANTO COMPANY (US) 1980-02-12 US disclosed
US-3993489-A Multi-color laminate of photopolymer that is image-wise hydroperoxidized MONSANTO COMPANY (US) 1976-11-23 US disclosed
US-3992209-A Imagewise distribution of sulfate group on substrate polymer by photographic techniques MONSANTO COMPANY (US) 1976-11-16 US disclosed