SCHEMBL5034612

SCHEMBL5034612

C=C(C)c1cccc(-c2cccc(CC)c2)c1

nearest known ligand 0.54

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
BCL2 P10415 1/20 0.54
IDO1 P14902 1/20 0.49
PTGS2 P35354 1/20 0.45
FGFR1 P11362 1/20 0.43
NISCH Q9Y2I1 1/20 0.41
CHRM3 P20309 1/20 0.39
NOTUM Q6P988 1/20 0.39
CNR2 P34972 1/20 0.38
CTSS P25774 1/20 0.38
CTSK P43235 1/20 0.38
DHFR P00374 2/20 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
SCHEMBL1363307 0.89 BCL2 (0.43) BCL2IDO1CNR2
SCHEMBL5034607 0.88 BCL2 (0.49) BCL2PTGS2FGFR1DHFR
SCHEMBL5080192 0.84 KMO (0.45)
SCHEMBL5547358 0.80 BCL2 (0.62) BCL2IDO1PTGS2FGFR1NISCH
SCHEMBL29489424 0.80 BCL2 (0.62) BCL2IDO1PTGS2FGFR1NISCH
SCHEMBL29100426 0.79 BCL2 (0.41) BCL2CNR2
SCHEMBL2135450 0.79 KMO (0.55)
SCHEMBL12894987 0.79 BCL2 (0.78) BCL2PTGS2DHFR
SCHEMBL13818514 0.77 BCL2 (0.71) BCL2IDO1PTGS2FGFR1NISCH
SCHEMBL172981 0.77 BCL2 (0.61) BCL2IDO1PTGS2DHFR

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-7402645-B2 Soluble polyfunctional vinyl aromatic polymer and method of producing the same NIPPON STEEL CHEMICAL CO., LTD. (JP) 2008-07-22 US disclosed
US-20070155923-A1 Soluble polyfunctional vinyl aromatic polymer and method of producing the same NIPPON STEEL CHEMICAL CO., LTD. (JP) 2007-07-05 US disclosed