SCHEMBL8701309

SCHEMBL8701309

COc1ccc(N2CCN(C(=O)Nc3cc(C)c(C)nc3OC)CC2)cc1OC(C)=O

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RBP4 P02753 2/20 0.46
MAPT P10636 3/20 0.44
KMT2A Q03164 2/20 0.44
ALDH1A1 P00352 2/20 0.44
MEN1 O00255 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
LMNA P02545 2/20 0.43
TP53 P04637 2/20 0.43
USP2 O75604 1/20 0.43
POLB P06746 1/20 0.43
ALOX15 P16050 1/20 0.43
TSHR P16473 1/20 0.43
HSD17B10 Q99714 1/20 0.43
THRB P10828 1/20 0.43
ALK Q9UM73 3/20 0.42
P2RX7 Q99572 1/20 0.42
GAA P10253 1/20 0.42
HTR1A P08908 3/20 0.41
HTR1D P28221 3/20 0.41
HTR1B P28222 3/20 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
SCHEMBL8703418 0.90 RBP4 (0.46) RBP4MAPTKMT2AALDH1A1MEN1
SCHEMBL8704349 0.88 MAPT (0.49) RBP4MAPTKMT2AALDH1A1SMN1; SMN2
SCHEMBL8699449 0.88 RBP4 (0.48) RBP4MAPTKMT2AALDH1A1MEN1
SCHEMBL8703992 0.86 KMT2A (0.53) RBP4MAPTKMT2AALDH1A1MEN1
SCHEMBL8705667 0.84 MAPT (0.49) RBP4MAPTKMT2AALDH1A1MEN1
SCHEMBL8705216 0.83 RBP4 (0.49) RBP4MAPTKMT2AALDH1A1MEN1
SCHEMBL6954279 0.83 KMT2A (0.49) RBP4MAPTKMT2AALDH1A1SMN1; SMN2
SCHEMBL6652808 0.83 RBP4 (0.57) RBP4MAPTKMT2AALDH1A1MEN1
SCHEMBL27484486 0.82 KMT2A (0.62) MAPTKMT2AALDH1A1MEN1SMN1; SMN2
SCHEMBL6963524 0.81 KMT2A (0.43) RBP4MAPTKMT2AALDH1A1LMNA

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