SCHEMBL14801855

SCHEMBL14801855

COc1ccc(OC)c(C=CC(=O)Nc2c(O)cccc2C(=O)O)c1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NFKB1 P19838 2/20 0.53
JUN P05412 1/20 0.53
TRPA1 O75762 2/20 0.53
TRPM8 Q7Z2W7 1/20 0.53
CYP3A4 P08684 3/20 0.53
CYP1A2 P05177 2/20 0.53
CYP2C19 P33261 2/20 0.53
NPSR1 Q6W5P4 2/20 0.53
ALDH1A1 P00352 7/20 0.53
KDM4E B2RXH2 6/20 0.53
RECQL P46063 1/20 0.53
KMT2A Q03164 7/20 0.52
MEN1 O00255 6/20 0.52
MAPT P10636 6/20 0.52
GLA P06280 1/20 0.52
NPC1 O15118 3/20 0.52
LTB4R Q15722 1/20 0.52
LMNA P02545 1/20 0.52
PDE4D Q08499 2/20 0.51
PDE4A P27815 1/20 0.51

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
SCHEMBL14802101 0.83 MMP1 (0.62) JUNTRPA1CYP3A4CYP1A2CYP2C19
SCHEMBL14801976 0.83 TRPA1 (0.76) NFKB1JUNTRPA1TRPM8CYP3A4
SCHEMBL14802041 0.82 MEN1 (0.70) NFKB1CYP3A4CYP1A2CYP2C19NPSR1
SCHEMBL14801947 0.82 TRPM8 (0.58) NFKB1TRPA1TRPM8CYP1A2KMT2A
SCHEMBL14801992 0.80 ALDH1A1 (0.60) NFKB1CYP3A4CYP1A2CYP2C19NPSR1
SCHEMBL14801680 0.80 KDM1A (0.67) NFKB1JUNTRPA1CYP3A4CYP1A2
SCHEMBL14801934 0.77 NFKB1 (0.53) NFKB1JUNTRPA1TRPM8KMT2A
SCHEMBL8213614 0.77 NFKB1 (0.53) NFKB1JUNTRPA1TRPM8KMT2A
SCHEMBL5137641 0.77 MAOB (0.75) NFKB1JUNCYP2C19ALDH1A1KMT2A
SCHEMBL5137643 0.77 MAOB (0.75) NFKB1JUNCYP2C19ALDH1A1KMT2A

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
US-10280441-B2 Host cells and methods for producing cinnamoyl anthranilate and analogs thereof THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2019-05-07 US disclosed
US-20130078683-A1 Host Cells and Methods for Producing Cinnamoyl Anthranilate and Analogs Thereof THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2013-03-28 US disclosed