SCHEMBL15085530

SCHEMBL15085530

CC(NC(=O)c1cc(Cl)cc(Br)c1NC(=O)C1CC(c2cc([N+](=O)[O-])ccc2S(=O)(=O)O)=NN1c1ncccc1Cl)C1CC1

nearest known ligand 0.33

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.33
KMT2A Q03164 2/20 0.32
SMN1; SMN2 Q16637 2/20 0.30
HTT P42858 2/20 0.30
NPC1 O15118 1/20 0.30
RAB9A P51151 1/20 0.30
IDO1 P14902 1/20 0.30
MEN1 O00255 1/20 0.30
LMNA P02545 1/20 0.30
POLB P06746 1/20 0.30
MAPT P10636 1/20 0.30
XBP1 P17861 1/20 0.30
RECQL P46063 1/20 0.30
L3MBTL1 Q9Y468 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
SCHEMBL15085562 0.93 MALT1 (0.34) ALDH1A1KMT2ASMN1; SMN2HTTNPC1
SCHEMBL15085534 0.90 MALT1 (0.31) IDO1
SCHEMBL15085581 0.90 MALT1 (0.32) IDO1
SCHEMBL1147804 0.90 ALDH1A1 (0.34) ALDH1A1KMT2ASMN1; SMN2HTTNPC1
SCHEMBL15085646 0.88 P2RX7 (0.34) ALDH1A1KMT2ASMN1; SMN2HTTNPC1
SCHEMBL15085577 0.88 IDO1 (0.33) IDO1
SCHEMBL15085602 0.87 IDO1 (0.33) IDO1
SCHEMBL1148544 0.86 GPR17 (0.33) ALDH1A1KMT2ASMN1; SMN2IDO1
SCHEMBL1148232 0.84 GPR17 (0.35) ALDH1A1KMT2AMEN1
SCHEMBL15085596 0.84 MALT1 (0.35) ALDH1A1KMT2ASMN1; SMN2HTTNPC1

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-8481744-B2 Process for producing anthranilamide compound ISHIHARA SANGYO KAISHA, LTD. (JP) 2013-07-09 US disclosed