SCHEMBL6987913

SCHEMBL6987913

O=C(c1ccnc(C(=O)N(Cc2cccnc2)Cc2cccnc2)c1)N(Cc1cccnc1)Cc1cccnc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.48
HSD17B10 Q99714 2/20 0.48
LMNA P02545 2/20 0.48
RECQL P46063 2/20 0.48
POLB P06746 1/20 0.48
PKM P14618 1/20 0.44
KMT2A Q03164 1/20 0.44
CFTR P13569 1/20 0.44
NPSR1 Q6W5P4 1/20 0.44
TRPM8 Q7Z2W7 1/20 0.44
HTT P42858 2/20 0.43
CHRNB2 P17787 1/20 0.43
CHRNA4 P43681 1/20 0.43
HPGD P15428 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
KCNA5 P22460 1/20 0.42
GAA P10253 1/20 0.42
TSHR P16473 1/20 0.42
MMP13 P45452 1/20 0.42
NAPRT Q6XQN6 1/20 0.42

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
SCHEMBL6987911 0.92 ALDH1A1 (0.49) KDM4EHSD17B10LMNARECQLPOLB
SCHEMBL5210605 0.86 CFTR (0.55) KDM4EKMT2ACFTRTSHRL3MBTL1
SCHEMBL6238400 0.83 SLC2A1 (0.46) KDM4ELMNAPOLBKMT2ACFTR
SCHEMBL6985142 0.80 PKM (0.46) PKMKMT2ACFTRNPSR1HPGD
SCHEMBL6236957 0.80 MAPT (0.51) KMT2ACFTRHPGDSMN1; SMN2L3MBTL1
SCHEMBL5210601 0.79 KDM4E (0.56) KDM4EKMT2ACFTRTSHRL3MBTL1
SCHEMBL5214358 0.78 PPARG (0.55) LMNAKMT2ACFTRNPSR1TSHR
SCHEMBL17250907 0.78 KDM4E (0.50) KDM4EHSD17B10LMNARECQLPOLB
SCHEMBL29398881 0.78 KDM4E (0.50) KDM4EHSD17B10LMNARECQLPOLB
SCHEMBL6991932 0.78 MAPT (0.41) KDM4EKMT2ACFTRL3MBTL1ALDH1A1

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
EP-1362033-A1 PYRIDINE MATRIX METALLOPROTEINASE INHIBITORS Warner-Lambert Company LLC (US) 2003-11-19 EP claimed
WO-2002064568-A1 PYRIDINE MATRIX METALLOPROTEINASE INHIBITORS WARNER-LAMBERT COMPANY LLC (US) 2002-08-22 WO claimed