SCHEMBL6178269

SCHEMBL6178269

CC(=O)c1ccc(Oc2ccc(N)cn2)cc1C

nearest known ligand 0.63

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 6/20 0.63
POLB P06746 2/20 0.63
MEN1 O00255 3/20 0.51
KMT2A Q03164 3/20 0.51
ALDH1A1 P00352 2/20 0.51
BRCA1 P38398 1/20 0.51
HBB P68871 1/20 0.51
HSD17B10 Q99714 1/20 0.51
RAB9A P51151 2/20 0.49
KEAP1 Q14145 1/20 0.45
LIPE Q05469 1/20 0.39
GRM2 Q14416 1/20 0.39
CYSLTR1 Q9Y271 1/20 0.39
NNMT P40261 1/20 0.38
LMNA P02545 1/20 0.37
ACACB O00763 3/20 0.37
HTT P42858 1/20 0.37
NPSR1 Q6W5P4 1/20 0.37

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
SCHEMBL6178262 0.81 KDM4E (0.59) KDM4EPOLBMEN1KMT2AALDH1A1
SCHEMBL6175971 0.80 HSPB1 (0.55) MEN1KMT2AALDH1A1RAB9ALMNA
SCHEMBL6306219 0.77 KDM4E (1.00) KDM4EPOLBMEN1KMT2AALDH1A1
SCHEMBL5019825 0.77 KDM4E (0.69) KDM4EPOLBMEN1KMT2AALDH1A1
SCHEMBL6178868 0.77 KDM4E (0.63) KDM4EPOLBMEN1KMT2AALDH1A1
SCHEMBL13582441 0.76 KDM4E (0.56) KDM4EPOLBMEN1KMT2AALDH1A1
SCHEMBL13582444 0.76 KDM4E (0.56) KDM4EPOLBMEN1KMT2AALDH1A1
SCHEMBL23926996 0.74 KDM4E (0.78) KDM4EPOLBMEN1KMT2AALDH1A1
SCHEMBL30079741 0.74 KDM4E (0.78) KDM4EPOLBMEN1KMT2AALDH1A1
SCHEMBL9923972 0.74 KDM4E (0.53) KDM4EPOLBMEN1KMT2AALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1066261-B1 PYRIDINE DERIVATIVE AND PHARMACEUTICAL CONTAINING THE SAME OTSUKA PHARMA CO LTD (JP) 2005-11-23 EP disclosed
US-6511995-B1 Inhibits collagen synthesis, which is useful for prophylaxis or treatment of fibrosis OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2003-01-28 US disclosed
EP-1066261-A1 PYRIDINE DERIVATIVE AND PHARMACEUTICAL CONTAINING THE SAME OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2001-01-10 EP disclosed
WO-1999048871-A1 PYRIDINE DERIVATIVE AND PHARMACEUTICAL CONTAINING THE SAME OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1999-09-30 WO disclosed