SCHEMBL30142941

SCHEMBL30142941

CC(C)OC(=O)[C@@]1(C)CCCC[C@H]1C(=O)O

nearest known ligand 0.36

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
SLC1A2 P43004 1/20 0.36
SLC1A1 P43005 1/20 0.36
HSD11B1 P28845 1/20 0.34
LMNA P02545 1/20 0.31
PTPN1 P18031 1/20 0.30

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
SCHEMBL28949432 1.00 SLC1A2 (0.36) SLC1A2SLC1A1HSD11B1LMNAPTPN1
SCHEMBL249750 0.83 NR1H2 (0.36) SLC1A2SLC1A1HSD11B1LMNA
SCHEMBL6916576 0.81 MAPT (0.41) SLC1A2SLC1A1HSD11B1LMNA
SCHEMBL16825473 0.81 SLC1A2 (0.30) SLC1A2SLC1A1
SCHEMBL27208664 0.77 F10 (0.41) LMNAPTPN1
SCHEMBL9298567 0.77 SLC1A2 (0.33) SLC1A2SLC1A1HSD11B1LMNA
SCHEMBL158905 0.77 SLC1A2 (0.39) SLC1A2SLC1A1HSD11B1LMNAPTPN1
SCHEMBL19296162 0.77 SLC1A2 (0.39) SLC1A2SLC1A1HSD11B1LMNAPTPN1
SCHEMBL30142974 0.77 MAPT (0.35) SLC1A2SLC1A1LMNA
SCHEMBL11680145 0.76 F10 (0.36)

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
CN-111171195-B Propylene polymerization solid catalyst for reducing VOC and method for producing polypropylene using the same 韩华道达尔能源有限公司 2022-12-27 CN disclosed