SCHEMBL4881344

SCHEMBL4881344

CN(CCc1ccc2c(c1)OCO2)C(=O)/C=C/c1ccccc1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 3/20 0.57
NPC1 O15118 2/20 0.57
SMN1; SMN2 Q16637 1/20 0.57
TRPM8 Q7Z2W7 10/20 0.55
MAPT P10636 2/20 0.54
HPGD P15428 2/20 0.54
LMNA P02545 1/20 0.54
TP53 P04637 1/20 0.54
HDAC3 O15379 2/20 0.49
HDAC4 P56524 2/20 0.49
HDAC1 Q13547 2/20 0.49
HDAC7 Q8WUI4 2/20 0.49
HDAC2 Q92769 2/20 0.49
HDAC10 Q969S8 2/20 0.49
HDAC11 Q96DB2 2/20 0.49
HDAC8 Q9BY41 2/20 0.49
HDAC6 Q9UBN7 2/20 0.49
HDAC9 Q9UKV0 2/20 0.49
HDAC5 Q9UQL6 2/20 0.49
HTR2A P28223 1/20 0.49

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
SCHEMBL4881351 1.00 RAB9A (0.57) RAB9ANPC1SMN1; SMN2TRPM8MAPT
SCHEMBL4885125 0.91 TRPM8 (0.62) RAB9ANPC1SMN1; SMN2TRPM8MAPT
SCHEMBL4885116 0.91 TRPM8 (0.62) RAB9ANPC1SMN1; SMN2TRPM8MAPT
SCHEMBL14148789 0.83 L3MBTL1 (0.57) SMN1; SMN2TRPM8MAPTTP53HTR2A
SCHEMBL14148791 0.81 L3MBTL1 (0.61) RAB9ANPC1SMN1; SMN2TRPM8MAPT
SCHEMBL29407319 0.81 L3MBTL1 (0.61) RAB9ANPC1SMN1; SMN2TRPM8MAPT
SCHEMBL29786680 0.80 LTB4R (0.61) NPC1TRPM8HDAC3HDAC4HDAC1
SCHEMBL15219985 0.78 CYP3A4 (0.56) RAB9ASMN1; SMN2TRPM8LMNAHDAC3
SCHEMBL22423034 0.77 MAOB (0.67) RAB9ANPC1SMN1; SMN2MAPTHPGD
Zanthomamide SCHEMBL29407211 0.77 MAPT (0.87) RAB9ANPC1SMN1; SMN2MAPTHPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9894921-B2 Use of cinnamic acid derivatives containing nitrogen as flavouring agents SYMRISE AG (DE) 2018-02-20 US disclosed
US-9894921-B2 Use of cinnamic acid derivatives containing nitrogen as flavouring agents SYMRISE AG (DE) 2018-02-20 US disclosed
EP-2737807-B1 Use of nitrogen-containing derivatives of cinnamic acid as flavourants SYMRISE AG (DE) 2017-04-05 EP disclosed
US-20150272185-A1 USE OF CINNAMIC ACID DERIVATIVES CONTAINING NITROGEN AS FLAVOURING AGENTS SYMRISE AG (DE) 2015-10-01 US disclosed
US-20150272185-A1 USE OF CINNAMIC ACID DERIVATIVES CONTAINING NITROGEN AS FLAVOURING AGENTS SYMRISE AG (DE) 2015-10-01 US disclosed
US-9144248-B2 Cinnamamides as savory flavorings SYMRISE AG (DE) 2015-09-29 US disclosed
US-9144248-B2 Cinnamamides as savory flavorings SYMRISE AG (DE) 2015-09-29 US disclosed
EP-2737807-A1 Use of nitrogen-containing derivatives of cinnamic acid as flavourants Symrise AG (DE) 2014-06-04 EP disclosed
EP-2529632-B1 Cinnamic acid amides as spicy flavour agents SYMRISE AG (DE) 2013-08-28 EP disclosed
US-20120308703-A1 Cinnamamides as savory flavorings SYMRISE AG (DE) 2012-12-06 US disclosed
US-20120308703-A1 Cinnamamides as savory flavorings SYMRISE AG (DE) 2012-12-06 US disclosed
EP-2529632-A1 Cinnamic acid amides as spicy flavour agents Symrise AG (DE) 2012-12-05 EP disclosed
US-20080038386-A1 Use of a liquid cooling sensate to provide a pungent, warming or tingling sensate composition MOZA ASHOK K 2008-02-14 US disclosed