SCHEMBL27828367

SCHEMBL27828367

C=C(C(=O)OC(=O)c1ccc(-c2ccccc2N(C)C(=O)OC(C)(C)C)cc1[N+](=O)[O-])C(C)(C)C

nearest known ligand 0.33

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
BRD4 O60885 1/20 0.33
TACR1 P25103 2/20 0.33
ABCB1 P08183 1/20 0.32
PAX8 Q06710 1/20 0.31
MEN1 O00255 1/20 0.31
LMNA P02545 1/20 0.31
MAPT P10636 1/20 0.31
KMT2A Q03164 1/20 0.31
MET P08581 1/20 0.30

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
SCHEMBL1316834 0.89 BRD4 (0.37) BRD4TACR1ABCB1PAX8MEN1
SCHEMBL1317223 0.87 ABCB1 (0.38) BRD4TACR1ABCB1PAX8MEN1
SCHEMBL27828364 0.86 BRD4 (0.35) BRD4TACR1ABCB1PAX8MEN1
SCHEMBL28793940 0.84 BRD4 (0.41) BRD4ABCB1PAX8MEN1LMNA
SCHEMBL27989088 0.81 TRPV1 (0.39) ABCB1MEN1MAPTKMT2A
SCHEMBL28793937 0.77 ALDH1A1 (0.33) BRD4ABCB1MEN1MAPTKMT2A
SCHEMBL27989054 0.77 DRD1 (0.37) ABCB1MEN1LMNAMAPTKMT2A
SCHEMBL27847123 0.76 MAPT (0.44) BRD4TACR1MEN1MAPTKMT2A
SCHEMBL1315548 0.75 ABCB1 (0.37) ABCB1MEN1LMNAMAPTKMT2A
SCHEMBL1315657 0.75 ABCB1 (0.37) ABCB1MEN1MAPTKMT2A

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
CN-102333757-B N-acyl anthranilic acid derivative or salt thereof TOYAMA CHEMICAL CO LTD 2014-11-26 CN disclosed
CN-102333757-A N-acyl anthranilic acid derivative or salt thereof TOYAMA CHEMICAL CO LTD 2012-01-25 CN disclosed