SCHEMBL8955041

SCHEMBL8955041

N=C1NC(=N)c2cc3cc(SC4CCCCC4)ccc3cc21

nearest known ligand 0.52

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
MAOA P21397 4/20 0.52
MAOB P27338 4/20 0.52
PTGIR P43119 1/20 0.35
AR P10275 1/20 0.34

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
SCHEMBL8955116 0.98 MAOA (0.50) MAOAMAOBPTGIRAR
SCHEMBL28440703 0.77 MAOA (0.51) MAOAMAOBPTGIRAR
SCHEMBL22288286 0.75 MAOA (0.53) MAOAMAOBPTGIRAR
SCHEMBL23323158 0.73 MAOA (0.51) MAOAMAOBAR
SCHEMBL8956123 0.72 MAOA (0.77) MAOAMAOBPTGIRAR
SCHEMBL8955927 0.70 MAOA (0.76) MAOAMAOBPTGIRAR
SCHEMBL523108 0.69 MAOA (1.00) MAOAMAOBPTGIR
SCHEMBL23295277 0.68 MAOA (0.65) MAOAMAOBPTGIRAR
SCHEMBL19890876 0.67 MAOA (0.55) MAOAMAOBPTGIRAR
SCHEMBL22288156 0.67 MAOA (0.47) MAOAMAOB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5484685-A Naphthalocyanine derivatives, production thereof, optical recording medium using the same, and production thereof HITACHI, LTD. (JP) 1996-01-16 US disclosed
EP-0366440-B1 Naphthalocyanine derivatives, production thereof, optical recording medium using the same, and production thereof HITACHI CHEMICAL CO LTD (JP) 1994-06-08 EP disclosed
EP-0366440-A2 Naphthalocyanine derivatives, production thereof, optical recording medium using the same, and production thereof Hitachi Chemical Co., Ltd. (JP) 1990-05-02 EP disclosed