SCHEMBL8699470

SCHEMBL8699470

CCc1cc(NC(=O)N2CCN(c3ccccc3O)CC2)c(OC)nc1C

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.51
MEN1 O00255 2/20 0.51
GAA P10253 3/20 0.50
SMN1; SMN2 Q16637 2/20 0.50
RBP4 P02753 3/20 0.48
MAPT P10636 3/20 0.45
RAB9A P51151 1/20 0.45
MAPK1 P28482 3/20 0.43
KDM4E B2RXH2 2/20 0.43
L3MBTL1 Q9Y468 2/20 0.43
ALDH1A1 P00352 2/20 0.43
TSHR P16473 2/20 0.43
PKM P14618 1/20 0.43
USP2 O75604 1/20 0.43
HSD17B10 Q99714 1/20 0.43
PANK3 Q9H999 1/20 0.43
P2RY12 Q9H244 1/20 0.43
HTR1A P08908 1/20 0.42
HTR1D P28221 1/20 0.42
HTR1B P28222 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
SCHEMBL8703765 0.92 MAPT (0.47) KMT2AMEN1GAASMN1; SMN2RBP4
SCHEMBL8705064 0.91 HTR1A (0.52) KMT2ASMN1; SMN2RBP4MAPTRAB9A
SCHEMBL8705983 0.90 MAPT (0.57) KMT2AMEN1GAASMN1; SMN2RBP4
SCHEMBL8700940 0.90 RBP4 (0.61) KMT2AMEN1GAARBP4MAPT
SCHEMBL8704966 0.89 RBP4 (0.48) KMT2AMEN1GAASMN1; SMN2RBP4
SCHEMBL8702290 0.89 RBP4 (0.48) KMT2AMEN1GAASMN1; SMN2RBP4
SCHEMBL8704636 0.89 KMT2A (0.57) KMT2AMEN1SMN1; SMN2RBP4MAPT
SCHEMBL8700781 0.89 THRB (0.45) KMT2ARBP4MAPTRAB9AMAPK1
SCHEMBL8699044 0.89 KDM4E (0.51) KMT2AMEN1RBP4MAPTRAB9A
SCHEMBL8700902 0.88 CXCR3 (0.48) KMT2AMEN1SMN1; SMN2RBP4MAPT

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