SCHEMBL29824595

SCHEMBL29824595

Cc1cn([C@H]2CN(C(c3ccccc3)(c3ccccc3)c3ccccc3)CCO2)c(=O)[nH]c1=O

nearest known ligand 0.46

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
TK1 P04183 6/20 0.42
RNASE1 P07998 1/20 0.41
NT5M Q9NPB1 1/20 0.39
TK2 O00142 2/20 0.39
DHFR P00374 1/20 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
SCHEMBL14968223 0.82 TK1 (0.44) TK1RNASE1NT5MTK2DHFR
SCHEMBL9978645 0.82 TK1 (0.44) TK1RNASE1NT5MTK2DHFR
SCHEMBL23086299 0.82 TK1 (0.42) TK1RNASE1NT5MTK2DHFR
SCHEMBL27976013 0.82 TK1 (0.42) TK1RNASE1NT5MTK2DHFR
SCHEMBL9978644 0.81 TK1 (0.43) TK1RNASE1NT5MTK2DHFR
SCHEMBL14968221 0.81 TK1 (0.43) TK1RNASE1NT5MTK2DHFR
SCHEMBL19660825 0.81 TK1 (0.45) TK1RNASE1TK2
SCHEMBL409820 0.80 RNASE1 (0.50) TK1RNASE1TK2
SCHEMBL19953995 0.80 TK1 (0.44) TK1RNASE1TK2
SCHEMBL441127 0.80 RNASE1 (0.50) TK1RNASE1TK2

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
WO-2022230954-A1 METHOD FOR PRODUCING OLIGONUCLEIC ACID COMPOUND 日本新薬株式会社 2022-11-03 WO disclosed
CN-114981281-A Method for producing oligonucleotide compound 日本新药株式会社 2022-08-30 CN disclosed