SCHEMBL14802102

SCHEMBL14802102

O=C(O)c1ccccc1N(O)C(=O)C(O)=Cc1ccccc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.41
ALOX15 P16050 1/20 0.41
DHODH Q02127 1/20 0.40
TRPM8 Q7Z2W7 1/20 0.40
TRPA1 O75762 1/20 0.39
PTPN1 P18031 9/20 0.39
KDM4E B2RXH2 3/20 0.38
POLB P06746 1/20 0.38
MAPT P10636 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
LMNA P02545 1/20 0.38
AKR1C3 P42330 1/20 0.37
CA12 O43570 1/20 0.36
CA1 P00915 1/20 0.36
CA2 P00918 1/20 0.36
HMGB1 P09429 1/20 0.36
HPGD P15428 1/20 0.36
CA4 P22748 1/20 0.36
CA6 P23280 1/20 0.36
CA7 P43166 1/20 0.36

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
SCHEMBL14801940 0.74 LMNA (0.57) ALDH1A1TRPM8KDM4EPOLBMAPT
SCHEMBL11775173 0.72 ALDH1A1 (0.56) ALDH1A1ALOX15DHODHTRPM8TRPA1
SCHEMBL11774603 0.72 ALDH1A1 (0.56) ALDH1A1ALOX15DHODHTRPM8TRPA1
SCHEMBL22532257 0.72 ALDH1A1 (0.50) ALDH1A1ALOX15PTPN1KDM4EPOLB
SCHEMBL2776583 0.70 ALDH1A1 (0.59) ALDH1A1ALOX15PTPN1KDM4EPOLB
SCHEMBL1629563 0.70 AKR1C3 (0.50) ALDH1A1TRPM8MAPTTDP1LMNA
SCHEMBL13066508 0.68 ALDH1A1 (0.62) ALDH1A1ALOX15PTPN1KDM4EPOLB
SCHEMBL5698552 0.68 AKR1C3 (0.44) ALDH1A1DHODHTRPM8KDM4EPOLB
SCHEMBL23864380 0.67 ALDH1A1 (0.43) ALDH1A1ALOX15PTPN1KDM4EMAPT
SCHEMBL10834328 0.66 ALDH1A1 (0.52) ALDH1A1ALOX15PTPN1KDM4EPOLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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