SCHEMBL23008043

SCHEMBL23008043

C[C@@H]1CCC2C(C1)OC(=O)C2(C)C

nearest known ligand 0.41

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ ABCB1 P08183 1/20 0.41
▸ GAA P10253 2/20 0.34
▸ HPGD P15428 1/20 0.34
▸ TSHR P16473 1/20 0.34
▸ HSD17B10 Q99714 1/20 0.34
▸ MAPK1 P28482 1/20 0.32
▸ NPSR1 Q6W5P4 1/20 0.32
▸ KDM4E B2RXH2 1/20 0.31
▸ MEN1 O00255 1/20 0.31
▸ ALDH1A1 P00352 1/20 0.31
▸ MAPT P10636 1/20 0.31
▸ GFER P55789 1/20 0.31
▸ KMT2A Q03164 1/20 0.31
▸ PTGS2 P35354 1/20 0.30
▸ POLB P06746 1/20 0.30
▸ ATM Q13315 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
SCHEMBL8630325 1.00 ABCB1 (0.41) ABCB1GAAHPGDTSHRHSD17B10
SCHEMBL25784631 1.00 ABCB1 (0.41) ABCB1GAAHPGDTSHRHSD17B10
SCHEMBL8630324 1.00 ABCB1 (0.41) ABCB1GAAHPGDTSHRHSD17B10
SCHEMBL25782621 0.82 ABCB1 (0.43) ABCB1GAAHPGDTSHRHSD17B10
SCHEMBL18629597 0.82 ABCB1 (0.43) ABCB1GAAHPGDTSHRHSD17B10
SCHEMBL18614588 0.82 ABCB1 (0.43) ABCB1GAAHPGDTSHRHSD17B10
SCHEMBL24026905 0.82 ABCB1 (0.43) ABCB1GAAHPGDTSHRHSD17B10
SCHEMBL18629599 0.82 ABCB1 (0.43) ABCB1GAAHPGDTSHRHSD17B10
SCHEMBL18629603 0.82 ABCB1 (0.40) ABCB1GAAHPGDTSHRHSD17B10
SCHEMBL25784645 0.78 ABCB1 (0.35) ABCB1GAAHPGDTSHRHSD17B10

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
US-20210047283-A1 NOVEL LACTONE COMPOUND AND NOVEL ETHER COMPOUND TAKASAGO INTERNATIONAL CORPORATION (JP) 2021-02-18 — — US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20210047283-A1 NOVEL LACTONE COMPOUND AND NOVEL ETHER COMPOUND NR0B1, CBR1, DCXR ABCB1 2441/4885GAA 2954/4885HPGD 2778/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

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