SCHEMBL23722957

SCHEMBL23722957

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

nearest known ligand 0.68

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 3/20 0.60
ALDH1A1 P00352 8/20 0.55
HPGD P15428 2/20 0.55
CYP19A1 P11511 2/20 0.53
TRPA1 O75762 2/20 0.48
TRPM8 Q7Z2W7 2/20 0.48
TSHR P16473 2/20 0.46
LMNA P02545 2/20 0.46
MAPT P10636 2/20 0.46
USP2 O75604 1/20 0.46
NPSR1 Q6W5P4 1/20 0.46
MEN1 O00255 1/20 0.45
KMT2A Q03164 1/20 0.45
KDM4E B2RXH2 1/20 0.44
GAA P10253 1/20 0.44
MAPK1 P28482 1/20 0.44
CA1 P00915 1/20 0.44
CA2 P00918 1/20 0.44

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
SCHEMBL891570 1.00 EPHX1 (0.60) EPHX1ALDH1A1HPGDCYP19A1TRPA1
SCHEMBL13271704 1.00 EPHX1 (0.60) EPHX1ALDH1A1HPGDCYP19A1TRPA1
SCHEMBL18844821 1.00 EPHX1 (0.60) EPHX1ALDH1A1HPGDCYP19A1TRPA1
SCHEMBL12449336 1.00 EPHX1 (0.60) EPHX1ALDH1A1HPGDCYP19A1TRPA1
SCHEMBL57397 1.00 EPHX1 (0.60) EPHX1ALDH1A1HPGDCYP19A1TRPA1
SCHEMBL17255739 1.00 EPHX1 (0.60) EPHX1ALDH1A1HPGDCYP19A1TRPA1
SCHEMBL57396 1.00 EPHX1 (0.60) EPHX1ALDH1A1HPGDCYP19A1TRPA1
SCHEMBL4256862 1.00 EPHX1 (0.60) EPHX1ALDH1A1HPGDCYP19A1TRPA1
SCHEMBL21250767 1.00 EPHX1 (0.60) EPHX1ALDH1A1HPGDCYP19A1TRPA1
SCHEMBL30797343 1.00 EPHX1 (0.60) EPHX1ALDH1A1HPGDCYP19A1TRPA1

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12239143-B2 Center-filled confectionery product; coated product; and methods of making INTERCONTINENTAL GREAT BRANDS LLC (US) 2025-03-04 US disclosed
CN-117222387-A Packaged absorbent article 宝洁公司 2023-12-12 CN disclosed
US-20210244044-A1 CENTER-FILLED CONFECTIONERY PRODUCT; COATED PRODUCT; AND METHODS OF MAKING INTERCONTINENTAL GREAT BRANDS LLC 2021-08-12 US disclosed