SCHEMBL13820565

SCHEMBL13820565

O[C@H]1CC[C@@H]2[C@H]1CC[C@@H]2O

nearest known ligand 0.31

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.31
CA1 P00915 1/20 0.30
CA2 P00918 1/20 0.30
CA4 P22748 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
SCHEMBL22006157 1.00 TSHR (0.31) TSHRCA1CA2CA4
SCHEMBL15077614 1.00 TSHR (0.31) TSHRCA1CA2CA4
SCHEMBL27386480 1.00 TSHR (0.31) TSHRCA1CA2CA4
SCHEMBL17803280 1.00 TSHR (0.31) TSHRCA1CA2CA4
SCHEMBL11217184 0.84 TSHR (0.44) TSHRCA1CA2CA4
SCHEMBL561318 0.84 TSHR (0.44) TSHRCA1CA2CA4
SCHEMBL22451052 0.81
SCHEMBL14923183 0.80 CA1 (0.39) CA1CA2CA4
Nitric Acid SCHEMBL10744127 0.78 CA5A (0.44) CA2
SCHEMBL239138 0.75 CA1 (0.40) TSHRCA1CA2CA4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20260001877-A1 HETEROARYL COMPOUNDS FOR THE TREATMENT OF PAIN VERTEX PHARMACEUTICALS INCORPORATED (US) 2026-01-01 US disclosed
US-8585924-B2 Compound having bicyclo[3.3.0]octane-2,6-diyl, liquid crystal composition and liquid crystal display device JNC CORPORATION (JP) 2013-11-19 US disclosed
US-20120286200-A1 COMPOUND HAVING BICYCLO[3.3.0]OCTANE-2,6-DIYL, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE JNC PETROCHEMICAL CORPORATION (JP) 2012-11-15 US disclosed
US-20120286200-A1 COMPOUND HAVING BICYCLO[3.3.0]OCTANE-2,6-DIYL, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE JNC PETROCHEMICAL CORPORATION (JP) 2012-11-15 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 (2 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-20120286200-A1 COMPOUND HAVING BICYCLO[3.3.0]OCTANE-2,6-DIYL, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE CCDC22, PIEZO1, OCIAD2 TSHR 4458/4885CA1 1285/4885CA2 1880/4885
US-20260001877-A1 HETEROARYL COMPOUNDS FOR THE TREATMENT OF PAIN CNR1, SCN1B, OPRL1 TSHR 575/4885CA1 781/4885CA2 213/4885

“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.