SCHEMBL11549010

SCHEMBL11549010

C=Cc1c(CC)cncc1CC.C=Cc1cncc(C)c1

nearest known ligand 0.38

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
GRM5 P41594 1/20 0.38
HDAC8 Q9BY41 1/20 0.37
TP53 P04637 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
PTGS2 P35354 1/20 0.35
HCAR2 Q8TDS4 1/20 0.33
PDXK O00764 1/20 0.32
ATM Q13315 1/20 0.31

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
SCHEMBL989929 0.84
SCHEMBL4018942 0.82 PDXK (0.37) HDAC8PDXK
SCHEMBL10535166 0.71 TDP1 (0.48) GRM5TP53TDP1PTGS2
SCHEMBL4022995 0.71 HDAC8 (0.39) GRM5HDAC8PTGS2
SCHEMBL1638461 0.69 PDXK (0.43) HDAC8TP53TDP1PTGS2PDXK
SCHEMBL6551393 0.69 HDAC8 (0.46) GRM5HDAC8TP53TDP1PTGS2
SCHEMBL28342562 0.68 PDXK (0.42) TP53TDP1PTGS2PDXK
SCHEMBL30471364 0.68
SCHEMBL1521255 0.68
SCHEMBL25401092 0.65

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-4154772-A PHENOLIC RESIN CONNECTED TO ADDITION POLYMER THE FIRESTONE TIRE & RUBBER COMPANY (US) 1979-05-15 US disclosed
US-4154773-A UREA-ALDEHYDE POLYMER COUPLED TO ADDITION POLYMER THE FIRESTONE TIRE & RUBBER COMPANY (US) 1979-05-15 US disclosed