SCHEMBL7807433

SCHEMBL7807433

CC(=O)Cc1ccc(Oc2ccc(N)cn2)cc1

nearest known ligand 0.55

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 6/20 0.55
MEN1 O00255 2/20 0.55
KMT2A Q03164 2/20 0.55
POLB P06746 3/20 0.55
RAB9A P51151 1/20 0.55
ALDH1A1 P00352 1/20 0.47
BRCA1 P38398 1/20 0.47
HBB P68871 1/20 0.47
HSD17B10 Q99714 1/20 0.47
OPRM1 P35372 2/20 0.44
OPRD1 P41143 2/20 0.44
OPRK1 P41145 2/20 0.44
ACACB O00763 10/20 0.44
ACACA Q13085 5/20 0.44

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
SCHEMBL3142591 0.86 KDM4E (0.52) KDM4EMEN1KMT2APOLBRAB9A
SCHEMBL3693246 0.83 OPRM1 (0.64) OPRM1OPRD1OPRK1
SCHEMBL6178262 0.81 KDM4E (0.59) KDM4EMEN1KMT2APOLBRAB9A
SCHEMBL9267594 0.80 LMNA (0.63) RAB9A
SCHEMBL2310157 0.80 KDM4E (0.51) KDM4EMEN1KMT2APOLBRAB9A
SCHEMBL2310168 0.80 KDM4E (0.51) KDM4EMEN1KMT2APOLBRAB9A
SCHEMBL4790595 0.79 OPRM1 (0.55) KDM4EMEN1KMT2APOLBRAB9A
SCHEMBL15643190 0.79 KDM4E (0.65) KDM4EMEN1KMT2APOLBRAB9A
SCHEMBL7810467 0.78 KDM4E (0.59) KDM4EMEN1KMT2APOLBRAB9A
SCHEMBL7810519 0.78 KDM4E (0.59) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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