SCHEMBL10697439

SCHEMBL10697439

CCOC(=O)C(C)Oc1nc(Oc2c(Cl)cc(C(F)(F)F)cc2Cl)ccc1[N+](=O)[O-]

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 4/20 0.38
KMT2A Q03164 4/20 0.38
TDP1 Q9NUW8 2/20 0.38
TTR P02766 1/20 0.38
PPOX P50336 1/20 0.38
PPARD Q03181 1/20 0.37
ALDH1A1 P00352 3/20 0.36
LMNA P02545 2/20 0.36
MAPT P10636 2/20 0.36
NPSR1 Q6W5P4 2/20 0.36
CYP3A4 P08684 2/20 0.36
CYP1A2 P05177 1/20 0.36
CYP2C19 P33261 1/20 0.36
RECQL P46063 1/20 0.36
KDM4E B2RXH2 1/20 0.36
MAOA P21397 1/20 0.35
FGFR4 P22455 1/20 0.35
IDH1 O75874 1/20 0.34
TSHR P16473 2/20 0.34
HPGD P15428 1/20 0.34

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
SCHEMBL10696569 0.91 MEN1 (0.36) MEN1KMT2ATDP1TTRPPOX
SCHEMBL11007482 0.89 MEN1 (0.48) MEN1KMT2ATDP1TTRPPOX
SCHEMBL10699015 0.89 TDP1 (0.42) MEN1KMT2ATDP1TTRPPOX
SCHEMBL10696298 0.87 ALDH1A1 (0.34) MEN1KMT2ATDP1PPARDALDH1A1
SCHEMBL10696366 0.82 RAB9A (0.35) TDP1ALDH1A1LMNAMAPTNPSR1
SCHEMBL10697769 0.79 TDP1 (0.38) MEN1KMT2ATDP1TTRPPOX
SCHEMBL11036501 0.77 KMT2A (0.44) MEN1KMT2ATDP1TTRPPOX
SCHEMBL11010421 0.77 MERTK (0.48) MEN1KMT2ATDP1ALDH1A1LMNA
SCHEMBL30806808 0.77 MERTK (0.48) MEN1KMT2ATDP1ALDH1A1LMNA
SCHEMBL11118813 0.76 MEN1 (0.50) MEN1KMT2ATDP1TTRPPOX

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-0272533-A2 Substituted phenoxypyridines BAYER AG (DE) 1988-06-29 EP disclosed