SCHEMBL25607768

SCHEMBL25607768

CC(C)(C)C(=O)OC[C@H]1O[C@@](C)(c2ccc3c(N)ncnn23)[C@H](O)[C@@H]1O

nearest known ligand 0.47

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ POLRMT O00411 1/20 0.34
▸ TMPRSS2 O15393 1/20 0.33
▸ DOT1L Q8TEK3 2/20 0.31
▸ RIPK1 Q13546 2/20 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
SCHEMBL24312545 0.94 POLRMT (0.33) POLRMTTMPRSS2DOT1LRIPK1
SCHEMBL24917203 0.93 POLRMT (0.32) POLRMTTMPRSS2DOT1L
SCHEMBL24312549 0.89 POLRMT (0.35) POLRMTTMPRSS2DOT1LRIPK1
SCHEMBL24790439 0.89 RNASEL (0.35) POLRMTTMPRSS2
SCHEMBL26317024 0.89 POLRMT (0.33) POLRMTTMPRSS2DOT1LRIPK1
SCHEMBL24313023 0.89 POLRMT (0.33) POLRMTTMPRSS2DOT1LRIPK1
SCHEMBL24791043 0.88 POLRMT (0.33) POLRMTTMPRSS2DOT1LRIPK1
SCHEMBL26213567 0.88 POLRMT (0.34) POLRMTTMPRSS2DOT1L
SCHEMBL24791044 0.88 POLRMT (0.33) POLRMTTMPRSS2DOT1LRIPK1
SCHEMBL24917062 0.88 POLRMT (0.34) POLRMTTMPRSS2DOT1LRIPK1

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-2023102472-A1 ANTIVIRAL PRODRUGS AND FORMULATIONS THEREOF THE SCRIPPS RESEARCH INSTITUTE (US) 2023-06-08 — — WO disclosed
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