SCHEMBL3146869

SCHEMBL3146869

COc1cc(CCCCCCO)ccc1O

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TAAR1 Q96RJ0 2/20 0.65
TSHR P16473 1/20 0.65
MAPK1 P28482 1/20 0.65
LMNA P02545 1/20 0.63
GLA P06280 1/20 0.63
PTPN1 P18031 2/20 0.61
CALM1 P0DP23 1/20 0.60
MTNR1A P48039 1/20 0.58
MTNR1B P49286 1/20 0.58
ALOX5 P09917 2/20 0.57
TUBB4A P04350 1/20 0.56
TUBB P07437 1/20 0.56
TUBA3C P0DPH7 1/20 0.56
TUBA1B P68363 1/20 0.56
TUBA4A P68366 1/20 0.56
TUBB4B P68371 1/20 0.56
TUBB3 Q13509 1/20 0.56
TUBB2A Q13885 1/20 0.56
TUBB8 Q3ZCM7 1/20 0.56
TUBA3E Q6PEY2 1/20 0.56

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
SCHEMBL1716450 1.00 TAAR1 (0.65) TAAR1TSHRMAPK1LMNAGLA
SCHEMBL11033626 1.00 TAAR1 (0.65) TAAR1TSHRMAPK1LMNAGLA
SCHEMBL3158703 0.98 TAAR1 (0.67) TAAR1TSHRMAPK1LMNAGLA
SCHEMBL29506903 0.93 TAAR1 (0.69) TAAR1TSHRMAPK1LMNAGLA
SCHEMBL200345 0.93 TAAR1 (0.69) TAAR1TSHRMAPK1LMNAGLA
SCHEMBL9281549 0.91 TAAR1 (0.76) TAAR1TSHRMAPK1LMNAGLA
Acetic Acid SCHEMBL29291133 0.91 MTNR1A (0.64) TAAR1TSHRMAPK1LMNAGLA
SCHEMBL5072123 0.88 TAAR1 (0.76) TAAR1TSHRMAPK1LMNAGLA
SCHEMBL9485313 0.87 HTR1A (0.72) TAAR1TSHRMAPK1LMNAGLA
SCHEMBL16609989 0.87 HTR1A (0.72) TAAR1TSHRMAPK1LMNAGLA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3453364-B1 HEAT GENERATOR KOBAYASHI PHARMACEUTICAL CO LTD (JP) 2022-08-24 EP claimed
EP-3348242-B1 HEATING COMPRESS KOBAYASHI PHARMACEUTICAL CO LTD (JP) 2022-06-29 EP claimed
EP-2810564-B1 Sensation masking composition TAKASAGO INT CORP (USA) (US) 2017-06-14 EP claimed
EP-1912516-B1 SENSATION MASKING COMPOSITION TAKASAGO INTERNAT CORP USA (US) 2014-06-25 EP claimed
EP-1215258-B1 Flavor composition for food and drink or for oral care preparation TAKASAGO PERFUMERY CO LTD (JP) 2010-02-17 EP claimed
EP-1215257-B1 Fragance composition TAKASAGO PERFUMERY CO LTD (JP) 2009-10-21 EP claimed