SCHEMBL8920654

SCHEMBL8920654

COc1cccc(C(c2ccccc2)(c2ccccc2)[C@]2(n3cc(C)c(=O)[nH]c3=O)C[C@H](O)[C@@H](CO)O2)c1OC

nearest known ligand 0.37

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
RNASE1 P07998 1/20 0.36
TK1 P04183 6/20 0.34
TOP2A P11388 1/20 0.34
TK2 O00142 2/20 0.33

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
SCHEMBL1706305 0.94 RNASE1 (0.38) RNASE1TK1TOP2ATK2
SCHEMBL9755145 0.94 RNASE1 (0.38) RNASE1TK1TOP2ATK2
Succinic Acid SCHEMBL1705784 0.90 RNASE1 (0.37) RNASE1TK1TOP2ATK2
SCHEMBL1705935 0.90 RNASE1 (0.35) RNASE1TK1TOP2ATK2
SCHEMBL7640415 0.88 RNASE1 (0.38) RNASE1TK1TK2
SCHEMBL1727535 0.87 RNASE1 (0.40) RNASE1TK1TK2
SCHEMBL8370048 0.86 RNASE1 (0.38) RNASE1TK1TK2
SCHEMBL7863893 0.85 RNASE1 (0.37) RNASE1TK1TOP2ATK2
SCHEMBL20636773 0.85 LMNA (0.38) RNASE1TOP2A
SCHEMBL3612838 0.85 TK1 (0.38) RNASE1TK1

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
US-5700642-A HYBRIDIZING PRIMER WITH COMPLEMENTARY TARGET NUCLEIC ACID, ENZYMATICALLY EXTENDING PRIMER TO GENERATE POLYNUCLEOTIDE MIXTURE, IMMOBILIZATION, CLEAVING TO RELEASE EXTENSION SEGMENT AND MEASUREMENT BY MASS SPECTROMETRY SRI INTERNATIONAL (US) 1997-12-23 US disclosed