SCHEMBL28020306

SCHEMBL28020306

COCCc1nccc(OC)n1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HTR7 P34969 1/20 0.37
▸ LOX P28300 1/20 0.37
▸ LOXL2 Q9Y4K0 1/20 0.37
▸ MTNR1A P48039 1/20 0.36
▸ MTNR1B P49286 1/20 0.36
▸ TAAR1 Q96RJ0 1/20 0.35
▸ NUDT1 P36639 1/20 0.35
▸ TSHR P16473 1/20 0.34
▸ PDE10A Q9Y233 3/20 0.34
▸ FGFR1 P11362 1/20 0.34
▸ FGFR2 P21802 1/20 0.34
▸ FGFR4 P22455 1/20 0.34
▸ FGFR3 P22607 1/20 0.34
▸ KDR P35968 1/20 0.34
▸ NOS2 P35228 2/20 0.33
▸ NOS3 P29474 1/20 0.33
▸ NOS1 P29475 1/20 0.33
▸ KLKB1 P03952 1/20 0.33
▸ TNKS O95271 1/20 0.33
▸ PARP1 P09874 1/20 0.33

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
SCHEMBL13827585 0.83 PDE10A (0.43) HTR7LOXLOXL2MTNR1AMTNR1B
SCHEMBL8496930 0.81 LOX (0.39) HTR7LOXLOXL2MTNR1AMTNR1B
SCHEMBL29442793 0.81 LOX (0.39) HTR7LOXLOXL2MTNR1AMTNR1B
SCHEMBL28128988 0.79 TSHR (0.35) HTR7TSHRPDE10ANOS2
SCHEMBL28019823 0.79 HTR7 (0.58) HTR7LOXLOXL2MTNR1AMTNR1B
SCHEMBL83512 0.79 PDE10A (0.44) HTR7TAAR1PDE10AFGFR1FGFR2
SCHEMBL2632841 0.79 TAAR1 (0.41) LOXLOXL2MTNR1AMTNR1BTAAR1
SCHEMBL28020330 0.78 TSHR (0.38) LOXLOXL2MTNR1AMTNR1BTAAR1
SCHEMBL7712102 0.77 MTNR1A (0.37) HTR7LOXLOXL2MTNR1AMTNR1B
SCHEMBL3511885 0.77 LOXL2 (0.52) HTR7LOXLOXL2MTNR1AMTNR1B

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
CN-104725397-A Thienopyrimidine derivatives, a process for their preparation and pharmaceutical compositions containing them SERVIER LAB 2015-06-24 — — CN disclosed
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