SCHEMBL9626819

SCHEMBL9626819

O=C1CCc2c(ccc3c2CCCO3)N1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PKM P14618 1/20 0.39
▸ HTR2A P28223 7/20 0.36
▸ HTR2C P28335 6/20 0.36
▸ HTR2B P41595 6/20 0.36
▸ HTR1A P08908 5/20 0.36
▸ HTR1D P28221 3/20 0.36
▸ NOTUM Q6P988 1/20 0.36
▸ NPC1 O15118 1/20 0.36
▸ MAPK13 O15264 1/20 0.36
▸ MAPK12 P53778 1/20 0.36
▸ MAPK11 Q15759 1/20 0.36
▸ MAPK14 Q16539 1/20 0.36
▸ DRD2 P14416 1/20 0.35
▸ KIF11 P52732 3/20 0.35
▸ MAPT P10636 1/20 0.34
▸ MMP12 P39900 1/20 0.34
▸ HTR6 P50406 2/20 0.34
▸ HTR4 Q13639 2/20 0.34
▸ ADRA2A P08913 1/20 0.34
▸ ADRA2C P18825 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
SCHEMBL1143507 0.76 HTR2C (0.45) HTR2AHTR2CHTR2BHTR1AHTR1D
SCHEMBL9627709 0.73 BRD4 (0.36) PKMNPC1MAPK13MAPK12MAPK11
SCHEMBL9626749 0.72 PDE4D (0.38) NPC1MAPK13MAPK12MAPK11MAPK14
SCHEMBL15964648 0.71 MAPT (0.53) NPC1MAPK13MAPK12MAPK11MAPK14
SCHEMBL9095936 0.69 DRD2 (0.35) HTR2AHTR2BNPC1MAPK13MAPK12
Hydrochloric Acid SCHEMBL9095687 0.68 DRD2 (0.35) HTR2AHTR2BNPC1MAPK13MAPK12
SCHEMBL14993793 0.68 HTR2C (0.36) HTR2AHTR2CHTR2BHTR1AHTR1D
SCHEMBL4708855 0.68 DYRK1A (0.40) HTR2AHTR2CHTR2BHTR1AHTR1D
SCHEMBL4786408 0.67 DRD2 (0.37) PKMHTR2AHTR2BDRD2MMP12
SCHEMBL23461782 0.67 KIF11 (0.36) PKMNOTUMNPC1MAPK13MAPK12

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5093339-A Anticoagulant, hypotensive, antiangina, antiasthma, antiulcer, anti-platelet activating factor KODAMA KABUSHIKI KAISHA (JP) 1992-03-03 — — US disclosed
EP-0355689-A2 Pyrano [f] quinoline derivatives and pharmaceutical compositions containing the same KODAMA KABUSHIKI KAISHA (JP) 1990-02-28 — — EP disclosed
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