SCHEMBL547347

SCHEMBL547347

CC1CCCCCCCCCCC(=O)OC1

nearest known ligand 0.49

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CYP2D6 P10635 2/20 0.49
KMT2A Q03164 1/20 0.48
CA1 P00915 3/20 0.45
CA2 P00918 1/20 0.45
CA4 P22748 1/20 0.45
CA9 Q16790 2/20 0.43
CYP2C19 P33261 2/20 0.37
CASP1 P29466 1/20 0.37
CYP3A4 P08684 1/20 0.37
ALDH1A1 P00352 1/20 0.35
LMNA P02545 1/20 0.35
TP53 P04637 1/20 0.35
TSHR P16473 1/20 0.35
FKBP4 Q02790 3/20 0.34
SLC6A3 Q01959 8/20 0.33
SLC6A4 P31645 6/20 0.33
SLC6A2 P23975 5/20 0.33

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
SCHEMBL3822239 1.00 CYP2D6 (0.49) CYP2D6KMT2ACA1CA2CA4
SCHEMBL8846065 1.00 CYP2D6 (0.49) CYP2D6KMT2ACA1CA2CA4
SCHEMBL3821804 1.00 CYP2D6 (0.49) CYP2D6KMT2ACA1CA2CA4
SCHEMBL29399931 1.00 CYP2D6 (0.49) CYP2D6KMT2ACA1CA2CA4
SCHEMBL2719598 1.00 CYP2D6 (0.49) CYP2D6KMT2ACA1CA2CA4
SCHEMBL15577086 1.00 CYP2D6 (0.49) CYP2D6KMT2ACA1CA2CA4
SCHEMBL179200 0.98 CYP2D6 (0.50) CYP2D6KMT2ACA1CA2CA4
SCHEMBL18268908 0.98 CYP2D6 (0.50) CYP2D6KMT2ACA1CA2CA4
SCHEMBL3956872 0.93 CA1 (0.57) CYP2D6KMT2ACA1CA2CA4
SCHEMBL10704300 0.91

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 34 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3005884-B1 TASTE MODULATOR AND METHOD OF USE THEREOF INT FLAVORS & FRAGRANCES INC (US) 2017-04-19 EP disclosed
EP-3005884-A1 TASTE MODULATOR AND METHOD OF USE THEREOF International Flavors & Fragrances Inc. (US) 2016-04-13 EP disclosed
US-20150104398-A1 TASTE MODULATOR AND METHOD OF USE THEREOF INTERNATIONAL FLAVORS & FRAGRANCES INC. 2015-04-16 US disclosed
US-8853269-B2 Composition and method for treating infections and promoting intestinal health Copperhead Chemical Company Inc. (US) 2014-10-07 US disclosed
US-20130337090-A1 PLANT EXTRACTS FOR TREATING BURNS AND CHRONIC WOUNDS SKIN MATRIX LTD. (IL) 2013-12-19 US disclosed
EP-2635291-A1 PLANT EXTRACTS FOR TREATING BURNS AND CHRONIC WOUNDS Skin Matrix Ltd. (IL) 2013-09-11 EP disclosed
US-8231913-B2 Angina pectoris and ischemic heart disease and synergistic phytoceutical composition for same OLALDE RANGEL JOSE ANGEL (VE) 2012-07-31 US disclosed
WO-2012059926-A1 PLANT EXTRACTS FOR TREATING BURNS AND CHRONIC WOUNDS SKIN MATRIX LTD. (IL) 2012-05-10 WO disclosed
US-8110230-B2 Synergistic phytoceutical compositions OLALDE RANGEL JOSE ANGEL (VE) 2012-02-07 US disclosed
US-8062680-B2 Synergistic phytoceutical compositions OLALDE RANGEL JOSE ANGEL (VE) 2011-11-22 US disclosed
US-20080160042-A1 Hepato Phyto-Nutraceutical Synergistic Composition OLALDE RANGEL JOSE ANGEL 2008-07-03 US disclosed
US-7381432-B2 Menopause disorder synergistic phyto-nutraceutical composition Olalde, Jose Angel (US) 2008-06-03 US disclosed
US-20080118584-A1 Renal Synergistic Phyto-Nutraceutical Composition OLALDE RANGEL JOSE ANGEL 2008-05-22 US disclosed
US-20080089946-A1 Synergistic Phytoceutical Compositions OLALDE RANGEL JOSE A 2008-04-17 US disclosed
US-20080069909-A1 MENOPAUSE DISORDER SYNERGISTIC PHYTO-NUTRACEUTICAL COMPOSITION HUNTER, JOCELYN 2008-03-20 US disclosed
US-7303772-B2 Synergistic phytoceutical compositions OLALDE RANGEL JOSE ANGEL 2007-12-04 US disclosed
US-20070275008-A1 Synergistic Diabetic Phyto-Nutraceutical Composition OLALDE RANGEL JOSE A 2007-11-29 US disclosed
WO-2007059441-A2 SYNERGISTIC PHYTOCEUTICAL COMPOSITIONS OLALDE RANGEL JOSE ANGEL (US) 2007-05-24 WO disclosed
US-20070104728-A1 Synergistic phytoceutical compositions OLALDE RANGEL JOSE A 2007-05-10 US disclosed
US-5936100-A METAL CARBENE COMPLEXES OF RUTHENIUM OR OSMIUM STUDIENGESELLSCHAFT KOHLE MBH (DE) 1999-08-10 US disclosed