SCHEMBL5087465

SCHEMBL5087465

N#Cc1c(Sc2ccc3ccccc3c2)ccc(Sc2ccc3ccccc3c2)c1C#N

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAP2K2 P36507 3/20 0.65
▸ MAP2K1 Q02750 3/20 0.65
▸ CA1 P00915 1/20 0.42
▸ CA2 P00918 1/20 0.42
▸ MAOA P21397 2/20 0.41
▸ MAOB P27338 2/20 0.41
▸ ALDH1A1 P00352 2/20 0.40
▸ HPGD P15428 2/20 0.40
▸ HAO1 Q9UJM8 1/20 0.40
▸ KDM4E B2RXH2 1/20 0.40
▸ MAPT P10636 1/20 0.40
▸ AR P10275 3/20 0.40
▸ ADORA2A P29274 1/20 0.40
▸ ADORA1 P30542 1/20 0.40
▸ LMNA P02545 1/20 0.39
▸ SMN1; SMN2 Q16637 1/20 0.39
▸ PLA2G1B P04054 1/20 0.39
▸ ATG4B Q9Y4P1 1/20 0.39
▸ PGR P06401 1/20 0.38
▸ RHEB Q15382 1/20 0.38

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
SCHEMBL30071586 0.78 ALDH1A1 (0.55) MAP2K2MAP2K1MAOAMAOBALDH1A1
SCHEMBL5074837 0.78 ALDH1A1 (0.55) MAP2K2MAP2K1MAOAMAOBALDH1A1
SCHEMBL30548745 0.78 MAP2K2 (0.48) MAP2K2MAP2K1CA1CA2ALDH1A1
SCHEMBL28286653 0.77 ALDH1A1 (0.72) MAP2K2MAP2K1CA1CA2MAOA
SCHEMBL14378074 0.76 MAOA (0.68) MAP2K2MAP2K1CA1CA2MAOA
SCHEMBL761802 0.75 LMNA (0.57) MAP2K2MAP2K1CA1CA2ALDH1A1
SCHEMBL30832956 0.75 LMNA (0.57) MAP2K2MAP2K1CA1CA2ALDH1A1
SCHEMBL18938570 0.73 MAP2K2 (0.54) MAP2K2MAP2K1CA1CA2MAOA
SCHEMBL5659555 0.73 MAP2K2 (0.46) MAP2K2MAP2K1ALDH1A1HPGDHAO1
SCHEMBL19259909 0.71 MAP2K2 (0.53) MAP2K2MAP2K1CA1CA2MAOA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7314511-B2 Metaloxyphthalocyanine compounds FUJIFILM IMAGING COLORANTS LIMITED (GB) 2008-01-01 — — US disclosed
US-7314511-B2 Metaloxyphthalocyanine compounds FUJIFILM IMAGING COLORANTS LIMITED (GB) 2008-01-01 — — US disclosed
US-7314511-B2 Metaloxyphthalocyanine compounds FUJIFILM IMAGING COLORANTS LIMITED (GB) 2008-01-01 — — US disclosed
EP-1537181-B1 METALOXYPHTHALOCYANINE COMPOUNDS FUJIFILM IMAGING COLORANTS LTD (GB) 2007-05-02 — — EP disclosed
EP-1537181-B1 METALOXYPHTHALOCYANINE COMPOUNDS FUJIFILM IMAGING COLORANTS LTD (GB) 2007-05-02 — — EP disclosed
US-20060000388-A1 Metaloxyphthalocyanine compounds AVECIA INKJET LIMITED (GB) 2006-01-05 — — US disclosed
EP-1537181-A1 METALOXYPHTHALOCYANINE COMPOUNDS Avecia Limited (GB) 2005-06-08 — — EP disclosed
WO-2004020529-A1 METALOXYPHTHALOCYANINE COMPOUNDS AVECIA LIMITED (GB) 2004-03-11 — — WO disclosed
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