SCHEMBL2830332

SCHEMBL2830332

CCC(Oc1c(C(C)(C)C)cc(Cc2cc(C(C)(C)C)c(OC(CC)C3CO3)c(C(C)(C)C)c2)cc1C(C)(C)C)C1CO1

nearest known ligand 0.33

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
DHFR P00374 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
SCHEMBL2831828 0.91
SCHEMBL2835787 0.89
SCHEMBL2832805 0.86 TP53 (0.31)
SCHEMBL2835776 0.82 DHFR (0.32) DHFR
SCHEMBL2832925 0.81 ESR1 (0.30)
SCHEMBL2832553 0.81
SCHEMBL2832688 0.79
SCHEMBL2833383 0.79
SCHEMBL2833431 0.78 DHFR (0.34) DHFR
SCHEMBL2836566 0.75 TP53 (0.30)

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-20100160555-A1 RESIN COMPOSITION SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2010-06-24 US disclosed
EP-2133380-A1 RESIN COMPOSITION Sumitomo Chemical Company, Limited (JP) 2009-12-16 EP disclosed