SCHEMBL13818693

SCHEMBL13818693

C=C(N=O)c1ccc(-c2cccc(CC)c2)cc1

nearest known ligand 0.63

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
BCL2 P10415 1/20 0.63
PTGS2 P35354 1/20 0.50
RXRA P19793 2/20 0.44
RXRB P28702 2/20 0.44
FGFR1 P11362 1/20 0.41
IDO1 P14902 1/20 0.40
MME P08473 1/20 0.40
AOC3 Q16853 6/20 0.39
DHFR P00374 2/20 0.39
HSD17B1 P14061 1/20 0.38
HSD17B2 P37059 1/20 0.38
NOTUM Q6P988 1/20 0.38

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
SCHEMBL13818514 0.81 BCL2 (0.71) BCL2PTGS2RXRARXRBFGFR1
SCHEMBL13818521 0.78 BCL2 (0.62) BCL2PTGS2RXRARXRBFGFR1
SCHEMBL13099462 0.78 BCL2 (0.76) BCL2PTGS2RXRARXRBFGFR1
SCHEMBL12894973 0.78 BCL2 (1.00) BCL2PTGS2RXRARXRBAOC3
SCHEMBL6640696 0.76 BCL2 (0.73) BCL2PTGS2RXRARXRBFGFR1
SCHEMBL17740358 0.75 BCL2 (0.71) BCL2PTGS2RXRARXRBDHFR
SCHEMBL13675346 0.75 BCL2 (0.71) BCL2PTGS2RXRARXRBFGFR1
SCHEMBL13814763 0.74 BCL2 (0.57) BCL2PTGS2RXRARXRBFGFR1
SCHEMBL9007144 0.74 BCL2 (0.65) BCL2PTGS2FGFR1IDO1MME
SCHEMBL29924029 0.74 BCL2 (0.65) BCL2PTGS2FGFR1IDO1MME

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-2070909-A1 Non-steroidal progesterone receptor modulators Bayer Schering Pharma AG (DE) 2009-06-17 EP disclosed