SCHEMBL6865670

SCHEMBL6865670

Cc1ccccc1NC(=O)c1ccc(NC(=O)c2cc([N+](=O)[O-])cc([N+](=O)[O-])c2)cc1

nearest known ligand 0.67

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 5/20 0.67
KMT2A Q03164 9/20 0.60
MEN1 O00255 8/20 0.60
MAPT P10636 4/20 0.60
HTT P42858 2/20 0.59
SMN1; SMN2 Q16637 2/20 0.59
ALDH1A1 P00352 1/20 0.59
LMNA P02545 1/20 0.59
MAPK1 P28482 1/20 0.59
OPRK1 P41145 1/20 0.59
NPSR1 Q6W5P4 1/20 0.59
TDP1 Q9NUW8 1/20 0.59
RAB9A P51151 2/20 0.57
NPC1 O15118 1/20 0.57
MITF O75030 1/20 0.57
POLB P06746 1/20 0.57
RORC P51449 1/20 0.55

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
SCHEMBL6864203 0.92 ALOX5 (0.67) ALOX5KMT2AMEN1MAPTHTT
SCHEMBL6866168 0.85 NPC1 (0.71) KMT2AMEN1MAPTHTTSMN1; SMN2
SCHEMBL28012109 0.82 KMT2A (0.68) KMT2AMEN1MAPTSMN1; SMN2ALDH1A1
SCHEMBL10904297 0.81 ALOX5 (1.00) ALOX5KMT2AMEN1MAPTSMN1; SMN2
SCHEMBL6866826 0.79 POLB (0.60) KMT2AMEN1MAPTHTTSMN1; SMN2
SCHEMBL11729838 0.78 ALOX5 (0.77) ALOX5KMT2AMEN1MAPTSMN1; SMN2
SCHEMBL8334964 0.78 ALOX5 (0.70) ALOX5KMT2AMEN1MAPTALDH1A1
SCHEMBL9055150 0.78 HPGD (0.89) KMT2AMEN1MAPTHTTSMN1; SMN2
SCHEMBL9232101 0.77 ALOX5 (0.66) ALOX5KMT2AMEN1HTTSMN1; SMN2
SCHEMBL7875424 0.77 ALOX5 (0.68) ALOX5KMT2AMEN1MAPTALDH1A1

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-6808766-B1 ALIGNMENT AGENT COMPRISING POLYURETHANE OR POLYUREA, USED IN ALIGNMENT OF LIQUID CRYSTAL MOLECULES THAT FORM LIQUID CRYSTAL ALIGNMENT FILM BY IRRADIATING THIN ALIGNMENT FILM FORMED ON SUBSTRATE WITH POLARIZED LIGHT OR ELECTRON RAYS NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2004-10-26 US disclosed
EP-1111442-A1 TREATING AGENT FOR LIQUID CRYSTAL ALIGNMENT LAYER AND LIQUID CRYSTAL DEVICE USING THE SAME, AND METHOD FOR ALIGNMENT OF LIQUID CRYSTAL Nissan Chemical Industries, Ltd. (JP) 2001-06-27 EP disclosed