SCHEMBL8699268

SCHEMBL8699268

CCc1cc(NC(=O)N2CCN(c3ccc(OC)c(O)c3)CC2)c(Oc2ccccc2)nc1C

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RBP4 P02753 2/20 0.49
KMT2A Q03164 3/20 0.45
GAA P10253 1/20 0.45
HSD17B10 Q99714 3/20 0.45
TP53 P04637 3/20 0.45
LMNA P02545 2/20 0.45
USP2 O75604 2/20 0.45
TSHR P16473 2/20 0.45
POLB P06746 1/20 0.45
ALOX15 P16050 1/20 0.45
MAPT P10636 4/20 0.44
HTT P42858 1/20 0.44
L3MBTL1 Q9Y468 2/20 0.43
MEN1 O00255 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
ALDH1A1 P00352 3/20 0.42
HCAR2 Q8TDS4 1/20 0.42
CCR4 P51679 1/20 0.42
MAPK1 P28482 2/20 0.42
PDGFRB P09619 3/20 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
SCHEMBL8699243 0.90 RBP4 (0.48) RBP4KMT2AGAAHSD17B10TP53
SCHEMBL8704961 0.88 KMT2A (0.49) RBP4KMT2AGAAHSD17B10TP53
SCHEMBL8699082 0.86 KMT2A (0.48) RBP4KMT2AGAAHSD17B10TP53
SCHEMBL8701257 0.86 MAPT (0.52) RBP4KMT2AGAAHSD17B10USP2
SCHEMBL8699350 0.85 KMT2A (0.53) RBP4KMT2AGAAHSD17B10TP53
SCHEMBL8701082 0.85 KMT2A (0.43) RBP4KMT2AGAAHSD17B10TP53
SCHEMBL8702972 0.84 KMT2A (0.48) RBP4KMT2AGAAHSD17B10TP53
SCHEMBL8705266 0.84 KMT2A (0.52) RBP4KMT2AGAAHSD17B10LMNA
SCHEMBL8703374 0.84 RBP4 (0.49) RBP4KMT2AGAAHSD17B10TP53
SCHEMBL8705216 0.83 RBP4 (0.49) RBP4KMT2AGAAHSD17B10TP53

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
US-5780472-A ANTITUMOR AGENTS SAMJIN PHARMACEUTICAZL CO., LTD. (KR) 1998-07-14 US disclosed
WO-1996021648-A1 NEW PIPERAZINE DERIVATIVES AND METHODS FOR THE PREPARATION THEREOF AND COMPOSITIONS CONTAINING THE SAME SAMJIN PHARMACEUTICAL CO., LTD. (KR) 1996-07-18 WO disclosed