SCHEMBL21901663

SCHEMBL21901663

COc1ccc(C(OCC2OC(n3cc(C)c(=O)[nH]c3=O)CC2OP(OCCCN)N(C(C)C)C(C)C)(c2ccccc2)c2ccc(OC)cc2)cc1

nearest known ligand 0.41

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
RNASE1 P07998 1/20 0.40
TK1 P04183 5/20 0.37
TK2 O00142 7/20 0.36

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
SCHEMBL21901667 0.95 RNASE1 (0.41) RNASE1TK1TK2
SCHEMBL21901662 0.94 TYMS (0.35) RNASE1TK1
SCHEMBL21901655 0.93 TYMS (0.35) RNASE1
SCHEMBL13213625 0.93 RNASE1 (0.42) RNASE1TK1TK2
SCHEMBL6324532 0.91 RNASE1 (0.45) RNASE1TK1TK2
SCHEMBL21901427 0.91 RNASE1 (0.40) RNASE1TK1TK2
SCHEMBL22984007 0.90 RNASE1 (0.40) RNASE1TK1TK2
SCHEMBL22872065 0.90 RNASE1 (0.40) RNASE1TK1TK2
SCHEMBL24115407 0.90 RNASE1 (0.40) RNASE1TK1TK2
SCHEMBL21901419 0.90 RNASE1 (0.40) RNASE1TK1TK2

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
WO-2020081744-A1 IMMUNOMODULATING POLYNUCLEOTIDE CONJUGATES AND METHODS OF USE TOLLNINE, INC. (US) 2020-04-23 WO disclosed