SCHEMBL7708175

SCHEMBL7708175

COC1C(I)[C@H](CO[Si](c2ccccc2)(c2ccccc2)C(C)(C)C)O[C@@H]1n1cc(C)c(=O)[nH]c1=O

nearest known ligand 0.41

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
TOP2A P11388 6/20 0.41
TYMP P19971 2/20 0.38
TK2 O00142 2/20 0.38
RNASE1 P07998 1/20 0.37
TK1 P04183 2/20 0.35
ALDH1A1 P00352 1/20 0.35
LMNA P02545 1/20 0.35
ALB P02768 1/20 0.35
POLB P06746 1/20 0.35
ADRA1A P35348 1/20 0.35
BLM P54132 1/20 0.35

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
SCHEMBL7708172 1.00 TOP2A (0.41) TOP2ATYMPTK2RNASE1TK1
SCHEMBL10647357 0.84 TK2 (0.45) TOP2ATYMPTK2RNASE1TK1
SCHEMBL10643570 0.84 TK2 (0.45) TOP2ATYMPTK2RNASE1TK1
SCHEMBL1738199 0.84 TOP2A (0.38) TOP2ATYMPTK2RNASE1TK1
SCHEMBL1738201 0.84 TOP2A (0.38) TOP2ATYMPTK2RNASE1TK1
SCHEMBL5668666 0.84 P2RY2 (0.44) TOP2A
SCHEMBL6853095 0.83 TYMP (0.39) TOP2ATYMPTK2RNASE1TK1
SCHEMBL7065019 0.83 TK2 (0.42) TOP2ATYMPTK2TK1
SCHEMBL7065021 0.83 TK2 (0.42) TOP2ATYMPTK2TK1
SCHEMBL10646821 0.82 TOP2A (0.41) TOP2ATYMPTK2RNASE1TK1

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-6359124-B1 NUCLEOTIDE SEQUENCES FOR USE IN THE DIAGNOSIS, DETECTION AND TREATMENT OF ARRHYTHMIA, LONG Q-T SYNDROME AND CANCERS ISIS PHARMACEUTICALS, INC. 2002-03-19 US disclosed