SCHEMBL3254206

SCHEMBL3254206

O=C(O)c1ccccc1NCC=Cc1ccccc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.53
HPGD P15428 2/20 0.53
HSD17B10 Q99714 2/20 0.53
TRPA1 O75762 6/20 0.52
RAB9A P51151 2/20 0.51
KDM4E B2RXH2 1/20 0.51
AGTR1 P30556 1/20 0.51
TRPM8 Q7Z2W7 3/20 0.50
DHODH Q02127 1/20 0.50
CTDSP1 Q9GZU7 2/20 0.49
L3MBTL1 Q9Y468 2/20 0.49
POLB P06746 1/20 0.49
TRPM2 O94759 1/20 0.48
LTB4R Q15722 1/20 0.48
MAOB P27338 1/20 0.47
PAM P19021 1/20 0.47
KMT2A Q03164 2/20 0.46
MEN1 O00255 1/20 0.44
NPC1 O15118 1/20 0.44
MAPT P10636 1/20 0.44

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
SCHEMBL11500237 1.00 ALDH1A1 (0.53) ALDH1A1HPGDHSD17B10TRPA1RAB9A
SCHEMBL29047127 0.86 TRPV1 (0.50) ALDH1A1HPGDHSD17B10TRPA1RAB9A
SCHEMBL9512857 0.85 KDM4E (0.56) ALDH1A1HPGDHSD17B10KDM4EL3MBTL1
SCHEMBL28420854 0.84 ALDH1A1 (0.47) ALDH1A1HPGDHSD17B10TRPA1KDM4E
Cinnamyl Anthranilate SCHEMBL30173478 0.83 ALDH1A1 (0.48) ALDH1A1HPGDHSD17B10TRPA1RAB9A
SCHEMBL4214999 0.83 ACLY (0.54) TRPM2LTB4R
SCHEMBL4220899 0.83 ACLY (0.54) TRPM2LTB4R
SCHEMBL30532232 0.82 CYSLTR2 (0.69) HPGDTRPA1TRPM8TRPM2
SCHEMBL4217437 0.81 RECQL (0.43) TRPA1KDM4ETRPM8POLBTRPM2
SCHEMBL4217443 0.81 RECQL (0.43) TRPA1KDM4ETRPM8POLBTRPM2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1894603-B1 Encapsulation of bulky fragrance molecules TAKASAGO PERFUMERY CO LTD (JP) 2014-11-19 EP claimed
EP-1967080-B1 Non-aldehyde cinnamon flavor and delivery systems therefor CADBURY ADAMS USA LLC (US) 2010-06-02 EP claimed
EP-2215050-A2 MANUFACTURING METHOD OF 2-HYDROXY-5-PHENYLALKYLAMINOBENZOIC ACID DERIVATIVES AND THEIR SALTS Neurotech Pharmaceuticals Co., Ltd. (KR) 2010-08-11 EP disclosed
WO-2009064084-A2 MANUFACTURING METHOD OF 2-HYDROXY-5-PHENYLALKYLAMINOBENZOIC ACID DERIVATIVES AND THEIR SALTS NEUROTECH CO., LTD. (KR) 2009-05-22 WO disclosed
US-4185115-A Antilipidemic para-[aryl(alkyl or alkenyl)amino]-benzoic acid derivatives AMERICAN CYANAMID COMPANY (US) 1980-01-22 US disclosed