SCHEMBL31253175

SCHEMBL31253175

CC1=CC(=O)CC(C)(C)[C@@]1(O)CC[C@@H](C)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ POLB P06746 3/20 0.46
▸ GAA P10253 2/20 0.46
▸ TYR P14679 6/20 0.44
▸ KDM4E B2RXH2 2/20 0.39
▸ RECQL P46063 2/20 0.39
▸ BLM P54132 1/20 0.39
▸ SYNJ2 O15056 2/20 0.36
▸ ABL1 P00519 1/20 0.36
▸ ALPL P05186 1/20 0.36
▸ ALPI P09923 1/20 0.36
▸ MAPT P10636 1/20 0.36
▸ ALPG P10696 1/20 0.36
▸ PABPC1 P11940 1/20 0.36
▸ GALK1 P51570 1/20 0.36
▸ CASP7 P55210 1/20 0.36
▸ CASP6 P55212 1/20 0.36
▸ MCL1 Q07820 1/20 0.36
▸ RIN1 Q13671 1/20 0.36
▸ EIF4H Q15056 1/20 0.36
▸ ALDH1A1 P00352 2/20 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
6S,9S-Roseoside SCHEMBL27125678 0.78 POLB (0.61) POLBGAATYRKDM4ERECQL
6S,9R-Roseoside SCHEMBL30205822 0.78 POLB (0.61) POLBGAATYRKDM4ERECQL
6S,9S-Roseoside SCHEMBL30771702 0.78 POLB (0.61) POLBGAATYRKDM4ERECQL
6S,9S-Roseoside SCHEMBL26980791 0.78 POLB (0.61) POLBGAATYRKDM4ERECQL
6S,9S-Roseoside SCHEMBL26980152 0.78 POLB (0.61) POLBGAATYRKDM4ERECQL
6S,9S-Roseoside SCHEMBL24481908 0.78 POLB (0.61) POLBGAATYRKDM4ERECQL
6S,9S-Roseoside SCHEMBL30771729 0.78 POLB (0.61) POLBGAATYRKDM4ERECQL
6S,9S-Roseoside SCHEMBL26980041 0.78 POLB (0.61) POLBGAATYRKDM4ERECQL
6S,9S-Roseoside SCHEMBL30771713 0.78 POLB (0.61) POLBGAATYRKDM4ERECQL
6S,9S-Roseoside SCHEMBL26979802 0.78 POLB (0.61) POLBGAATYRKDM4ERECQL

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
CN-119074745-A Hedera helix saponin composition, hedera helix leaf extract comprising the composition and application thereof 浙江康恩贝中药有限公司 2024-12-06 — — CN claimed
CN-119074745-A Hedera helix saponin composition, hedera helix leaf extract comprising the composition and application thereof 浙江康恩贝中药有限公司 2024-12-06 — — CN disclosed
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