SCHEMBL9715656

SCHEMBL9715656

COc1ccc(C#Cc2ccccc2)cc1.COc1ccc(C#Cc2ccccc2)cc1.[Pt]

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
APP P05067 3/20 0.63
KCNH2 Q12809 1/20 0.58
CA4 P22748 1/20 0.56
LTA4H P09960 2/20 0.54
MEN1 O00255 1/20 0.53
NPC1 O15118 1/20 0.53
POLB P06746 1/20 0.53
RAB9A P51151 1/20 0.53
KMT2A Q03164 1/20 0.53
NLRP3 Q96P20 1/20 0.53
L3MBTL1 Q9Y468 4/20 0.50
FFAR1 O14842 1/20 0.50
CA12 O43570 1/20 0.50
CA1 P00915 1/20 0.50
CA2 P00918 1/20 0.50
CA7 P43166 1/20 0.50
CA9 Q16790 1/20 0.50
CA14 Q9ULX7 1/20 0.50
TRPA1 O75762 1/20 0.48
MAPT P10636 1/20 0.48

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
SCHEMBL5552160 0.98 APP (0.65) APPKCNH2CA4LTA4HMEN1
SCHEMBL9715639 0.91 APP (0.74) APPKCNH2CA4LTA4HNPC1
SCHEMBL28151462 0.89 APP (0.55) APPKCNH2CA4LTA4HMEN1
SCHEMBL674764 0.88 APP (0.77) APPKCNH2CA4LTA4HNPC1
SCHEMBL10300057 0.88 APP (0.77) APPKCNH2CA4LTA4HNPC1
SCHEMBL8944277 0.86 APP (0.53) APPKCNH2CA4LTA4HMEN1
SCHEMBL28308740 0.84 APP (0.61) APPKCNH2CA4LTA4HMEN1
SCHEMBL16741894 0.84 CA4 (0.59) APPKCNH2CA4LTA4HMEN1
SCHEMBL28811444 0.84 APP (0.50) APPKCNH2CA4LTA4HMEN1
SCHEMBL12228189 0.83 CES2 (0.58) APPMEN1NPC1POLBRAB9A

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
US-5100702-A Decomposition of platinum-acetylene complex, electroconductivity NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 1992-03-31 US disclosed