SCHEMBL6180133

SCHEMBL6180133

Nc1ccc(Oc2ccc(C(=O)c3ccccc3)cc2)nc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 5/20 0.56
MEN1 O00255 3/20 0.56
KMT2A Q03164 3/20 0.56
POLB P06746 3/20 0.52
RAB9A P51151 1/20 0.52
OPRM1 P35372 6/20 0.51
OPRD1 P41143 6/20 0.51
OPRK1 P41145 6/20 0.51
SRD5A2 P31213 2/20 0.49
ALDH1A1 P00352 1/20 0.48
BRCA1 P38398 1/20 0.48
HBB P68871 1/20 0.48
HSD17B10 Q99714 1/20 0.48
GRIN2D O15399 1/20 0.46
GRIN3B O60391 1/20 0.46
SLC6A2 P23975 1/20 0.46
SLC6A3 Q01959 1/20 0.46
GRIN1 Q05586 1/20 0.46
KCNH2 Q12809 1/20 0.46
GRIN2A Q12879 1/20 0.46

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
SCHEMBL13983607 0.86 KDM4E (0.61) KDM4EMEN1KMT2APOLBRAB9A
SCHEMBL15643189 0.83 PARP10 (0.64) KDM4EMEN1KMT2APOLBRAB9A
SCHEMBL20844593 0.82 L3MBTL1 (0.54) POLBRAB9AOPRM1OPRD1OPRK1
SCHEMBL31674507 0.82 KDM4E (0.68) KDM4EMEN1KMT2APOLBRAB9A
SCHEMBL1002115 0.82 KDM4E (0.68) KDM4EMEN1KMT2APOLBRAB9A
SCHEMBL6178262 0.82 KDM4E (0.59) KDM4EMEN1KMT2APOLBRAB9A
SCHEMBL3455050 0.81 SRD5A2 (0.67) MEN1KMT2APOLBRAB9ASRD5A2
Hydrochloric Acid SCHEMBL8330166 0.81 KDM4E (0.66) KDM4EMEN1KMT2APOLBRAB9A
SCHEMBL26116916 0.80 KDM4E (0.53) KDM4EMEN1KMT2APOLBRAB9A
SCHEMBL4790593 0.80 KDM4E (0.54) KDM4EMEN1KMT2APOLBRAB9A

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