SCHEMBL2443029

SCHEMBL2443029

C=c1c(C(=O)O)cc(C2CCCCC2)c(C(=O)O)c1=C

nearest known ligand 0.43

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ACMSD Q8TDX5 2/20 0.43
KDM4E B2RXH2 1/20 0.38
MEN1 O00255 1/20 0.38
MAPT P10636 1/20 0.38
KMT2A Q03164 1/20 0.38
CAMKK2 Q96RR4 7/20 0.37
KMO O15229 2/20 0.37
CAMKK1 Q8N5S9 5/20 0.34
PTGDR2 Q9Y5Y4 6/20 0.34
PTGDR Q13258 3/20 0.34
KDM5A P29375 1/20 0.34
KDM5B Q9UGL1 1/20 0.34
PTGER2 P43116 1/20 0.34
DHODH Q02127 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
SCHEMBL14989244 0.79 KMO (0.45) ACMSDKDM4EMEN1MAPTKMT2A
SCHEMBL14989246 0.79 ACMSD (0.44) ACMSDKDM4EMEN1MAPTKMT2A
SCHEMBL3258518 0.77 ACMSD (0.43) ACMSDKDM4EMEN1MAPTKMT2A
SCHEMBL4566639 0.77 ACMSD (0.43) ACMSDKDM4EMEN1MAPTKMT2A
SCHEMBL253754 0.77 ACMSD (0.43) ACMSDKDM4EMEN1MAPTKMT2A
SCHEMBL9823221 0.75 ACMSD (0.44) ACMSDKDM4EMEN1MAPTKMT2A
SCHEMBL12478008 0.75 ACMSD (0.41) ACMSDKDM4EMEN1MAPTKMT2A
SCHEMBL14989275 0.75 ACMSD (0.44) ACMSDKDM4EMEN1MAPTKMT2A
SCHEMBL27492056 0.74 ACMSD (0.43) ACMSDKDM4EMEN1MAPTKMT2A
SCHEMBL17323522 0.74 KMO (0.50) ACMSDKDM4EMEN1MAPTKMT2A

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
EP-2152806-B1 POLYESTER POLYCARBONATE COMPOSITIONS, METHODS OF MAKING, AND ARTICLES FORMED THEREFROM SABIC INNOVATIVE PLASTICS IP (NL) 2011-09-14 EP claimed