Beta-Pinene

Beta-Pinene

SCHEMBL900792

C=C1CCC2CC1C2(C)C.C=C1CCC2CC1C2(C)C

nearest known ligand 0.38

Full drug profile on Sugi Atlas →

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.38
MAPK1 P28482 1/20 0.38
TRPA1 O75762 1/20 0.34
KDM4E B2RXH2 1/20 0.30
HTT P42858 1/20 0.30
TDP1 Q9NUW8 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
(+)-Beta-Pinene SCHEMBL3506800 1.00 TSHR (0.38) TSHRMAPK1TRPA1KDM4EHTT
Beta-Pinene SCHEMBL1636093 1.00 TSHR (0.38) TSHRMAPK1TRPA1KDM4EHTT
Beta-Pinene SCHEMBL13300 1.00 TSHR (0.38) TSHRMAPK1TRPA1KDM4EHTT
Beta-Pinene SCHEMBL1532504 1.00 TSHR (0.38) TSHRMAPK1TRPA1KDM4EHTT
Beta-Pinene SCHEMBL12971216 0.98 TSHR (0.36) TSHRMAPK1TRPA1
Beta-Pinene SCHEMBL6989826 0.98 TSHR (0.36) TSHRMAPK1TRPA1
Beta-Pinene SCHEMBL12971319 0.98 TSHR (0.36) TSHRMAPK1TRPA1
Beta-Pinene SCHEMBL12986238 0.98 TSHR (0.36) TSHRMAPK1TRPA1
Beta-Pinene SCHEMBL9785671 0.96 TSHR (0.35) TSHRMAPK1TRPA1
Beta-Pinene SCHEMBL5086803 0.90 TRPA1 (0.33) TSHRMAPK1TRPA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2621462-A1 ORAL CARE COMPOSITIONS WITH IMPROVED FLAVOR The Procter and Gamble Company (US) 2013-08-07 EP disclosed
WO-2012044728-A1 ORAL CARE COMPOSITIONS WITH IMPROVED FLAVOR THE PROCTER & GAMBLE COMPANY (US) 2012-04-05 WO disclosed