SCHEMBL13610272

SCHEMBL13610272

OC1CCCCCCCCCCC2OC2CCC1

nearest known ligand 0.56

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.56
LMNA P02545 1/20 0.31
PPP1CA P62136 1/20 0.31
ESR2 Q92731 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
SCHEMBL13610280 0.92 TSHR (0.53) TSHRLMNAPPP1CA
SCHEMBL50969 0.82 ALDH1A1 (0.33) TSHRLMNAPPP1CA
SCHEMBL8091631 0.82 ALDH1A1 (0.33) TSHRLMNAPPP1CA
SCHEMBL16460532 0.82 TSHR (0.83) TSHRESR2
SCHEMBL3192473 0.82
SCHEMBL23934877 0.82 ALDH1A1 (0.33) TSHRLMNAPPP1CA
SCHEMBL12335159 0.82 ALDH1A1 (0.33) TSHRLMNAPPP1CA
SCHEMBL18860776 0.82 TSHR (0.83) TSHRESR2
SCHEMBL20617904 0.82 ALDH1A1 (0.33) TSHRLMNAPPP1CA
SCHEMBL7944366 0.82 ALDH1A1 (0.33) TSHRLMNAPPP1CA

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-7615526-B2 Furanoid and pyranoid C14-C18- oxabicycloalkanones as odoriferous and/or aroma substances SYMRISE GMBH & CO. KG (DE) 2009-11-10 US disclosed
US-7615526-B2 Furanoid and pyranoid C14-C18- oxabicycloalkanones as odoriferous and/or aroma substances SYMRISE GMBH & CO. KG (DE) 2009-11-10 US disclosed
US-20080234174-A1 FURANOID AND PYRANOID C14-C18- OXABICYCLOALKANONES AS ODORIFEROUS AND/OR AROMA SUBSTANCES SYMRISE GMBH & CO. KG (DE) 2008-09-25 US disclosed
US-20080234174-A1 FURANOID AND PYRANOID C14-C18- OXABICYCLOALKANONES AS ODORIFEROUS AND/OR AROMA SUBSTANCES SYMRISE GMBH & CO. KG (DE) 2008-09-25 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-20080234174-A1 FURANOID AND PYRANOID C14-C18- OXABICYCLOALKANONES AS ODORIFEROUS AND/OR AROMA SUBSTANCES CYP19A1, OXER1, AKR1C4 TSHR 3618/4885LMNA 4098/4885PPP1CA 3319/4885

“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.