SCHEMBL10698064

SCHEMBL10698064

CCOc1cc([N+](=O)[O-])cc2ccc(C)nc12

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 6/20 0.53
MEN1 O00255 4/20 0.53
ALOX5 P09917 1/20 0.46
S1PR4 O95977 4/20 0.44
MAPT P10636 7/20 0.42
ALDH1A1 P00352 3/20 0.42
LMNA P02545 5/20 0.40
POLB P06746 1/20 0.40
NPC1 O15118 4/20 0.40
RAB9A P51151 3/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
RELA Q04206 2/20 0.40
NPSR1 Q6W5P4 1/20 0.40
KDM4E B2RXH2 1/20 0.40
PKM P14618 1/20 0.40
NFKB1 P19838 1/20 0.40
HTT P42858 1/20 0.40
CASP6 P55212 1/20 0.40
NFKB2 Q00653 1/20 0.40
TDP1 Q9NUW8 1/20 0.40

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
SCHEMBL10700964 0.76 KDM4E (0.44) KMT2AMEN1MAPTALDH1A1LMNA
SCHEMBL10698059 0.75 MAPT (0.54) KMT2AMEN1S1PR4MAPTALDH1A1
SCHEMBL10698493 0.75 ALDH1A1 (0.47) KMT2AMEN1ALOX5S1PR4MAPT
SCHEMBL7011056 0.73 NPC1 (0.67) KMT2AMEN1S1PR4MAPTALDH1A1
SCHEMBL5233148 0.72 MAPT (0.49) KMT2AMEN1MAPTALDH1A1LMNA
SCHEMBL8946550 0.71 ALDH1A1 (0.56) KMT2AMEN1MAPTALDH1A1LMNA
SCHEMBL29739542 0.71 ALDH1A1 (0.56) KMT2AMEN1MAPTALDH1A1LMNA
SCHEMBL1979913 0.71 ALDH1A1 (0.56) KMT2AMEN1MAPTALDH1A1LMNA
SCHEMBL7933244 0.71 MAPT (0.48) KMT2AMEN1MAPTALDH1A1LMNA
SCHEMBL7933249 0.71 POLB (0.56) KMT2AMEN1MAPTALDH1A1LMNA

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
EP-0282893-A2 Pesticides based on 1,10-phenanthrolines BAYER AG (DE) 1988-09-21 EP disclosed