SCHEMBL8700902

SCHEMBL8700902

CCc1cc(NC(=O)N2CCN(c3ccccc3-c3ccccc3)CC2)c(OC)nc1C

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CXCR3 P49682 1/20 0.48
KCNH2 Q12809 1/20 0.48
RBP4 P02753 3/20 0.46
FAAH O00519 1/20 0.45
SMN1; SMN2 Q16637 2/20 0.43
HTT P42858 2/20 0.43
MAPT P10636 2/20 0.43
RAB9A P51151 1/20 0.43
TRPV1 Q8NER1 2/20 0.42
KMT2A Q03164 3/20 0.42
L3MBTL1 Q9Y468 2/20 0.42
MEN1 O00255 2/20 0.42
THRB P10828 1/20 0.42
DRD2 P14416 1/20 0.42
DRD3 P35462 1/20 0.42
HSD17B10 Q99714 2/20 0.42
KDM4E B2RXH2 1/20 0.41
USP2 O75604 1/20 0.41
ALDH1A1 P00352 1/20 0.41
TSHR P16473 1/20 0.41

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
SCHEMBL6652409 0.90 KMT2A (0.48) CXCR3KCNH2MAPTKMT2AMEN1
SCHEMBL9057833 0.90 RBP4 (0.50) RBP4FAAHSMN1; SMN2MAPTRAB9A
SCHEMBL8702290 0.89 RBP4 (0.48) RBP4FAAHSMN1; SMN2MAPTRAB9A
SCHEMBL8705064 0.89 HTR1A (0.52) RBP4SMN1; SMN2HTTMAPTRAB9A
SCHEMBL8699566 0.88 HTR1A (0.53) RBP4FAAHSMN1; SMN2HTTMAPT
SCHEMBL8705983 0.88 MAPT (0.57) RBP4SMN1; SMN2MAPTRAB9ATRPV1
SCHEMBL8699470 0.88 KMT2A (0.51) RBP4SMN1; SMN2MAPTRAB9ATRPV1
SCHEMBL8700940 0.88 RBP4 (0.61) RBP4HTTMAPTRAB9ATRPV1
SCHEMBL8703773 0.87 RBP4 (0.51) RBP4FAAHSMN1; SMN2HTTMAPT
SCHEMBL8704636 0.87 KMT2A (0.57) RBP4SMN1; SMN2MAPTKMT2AL3MBTL1

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