SCHEMBL1670726

SCHEMBL1670726

OB(O)c1cc2ccccc2nc1Cl.OB(O)c1ccccc1F

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.41
MBNL1 Q9NR56 1/20 0.41
ALOX5 P09917 1/20 0.39
ALDH1A1 P00352 5/20 0.38
KDM4E B2RXH2 5/20 0.38
HPGD P15428 2/20 0.37
GLA P06280 2/20 0.37
MAPT P10636 2/20 0.37
ACHE P22303 1/20 0.37
TDP1 Q9NUW8 1/20 0.37
GAA P10253 3/20 0.37
STAT3 P40763 1/20 0.37
EGFR P00533 1/20 0.36
TOP2A P11388 1/20 0.36
TOP2B Q02880 1/20 0.36
SMN1; SMN2 Q16637 3/20 0.35
NPC1 O15118 3/20 0.35
RAB9A P51151 3/20 0.35
PKM P14618 1/20 0.35
NFKB1 P19838 1/20 0.35

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
SCHEMBL29955947 0.89 KMT2A (0.50) KMT2AALOX5ALDH1A1KDM4EHPGD
SCHEMBL115832 0.89 KMT2A (0.50) KMT2AALOX5ALDH1A1KDM4EHPGD
SCHEMBL29951444 0.77 ALDH1A1 (0.48) KMT2AMBNL1ALDH1A1KDM4EHPGD
SCHEMBL789653 0.77 ALDH1A1 (0.48) KMT2AMBNL1ALDH1A1KDM4EHPGD
SCHEMBL29468967 0.74 ENPP2 (0.46) MAPTACHEGAA
SCHEMBL115327 0.74 ENPP2 (0.46) MAPTACHEGAA
SCHEMBL538070 0.73 KMT2A (0.55) KMT2AMBNL1ALOX5ALDH1A1KDM4E
SCHEMBL29040533 0.72 ENPP2 (0.44) MAPTACHEGAA
SCHEMBL10185822 0.72 ENPP2 (0.44) ACHE
SCHEMBL16488132 0.70 ALDH1A1 (0.60) KMT2AMBNL1ALDH1A1KDM4EHPGD

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2012154213-A1 COFLUORONS AND METHODS OF MAKING AND USING THEM CORNELL UNIVERSITY (US) 2012-11-15 WO disclosed
EP-2485678-A1 COFERONS AND METHODS OF MAKING AND USING THEM Cornell University (US) 2012-08-15 EP disclosed
WO-2011043817-A1 COFERONS AND METHODS OF MAKING AND USING THEM CORNELL UNIVERSITY (US) 2011-04-14 WO disclosed