SCHEMBL8699764

SCHEMBL8699764

CCc1cc(NC(=O)CCl)c(OC)nc1C

nearest known ligand 0.49

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.46
NPC1 O15118 1/20 0.46
MITF O75030 1/20 0.46
THRB P10828 1/20 0.46
MAPK1 P28482 1/20 0.46
RAB9A P51151 1/20 0.46
ALDH1A1 P00352 10/20 0.45
LMNA P02545 4/20 0.45
SMN1; SMN2 Q16637 4/20 0.42
HTT P42858 1/20 0.42
EGFR P00533 1/20 0.39
GAA P10253 1/20 0.39
CASP2 P42575 1/20 0.39
MAPT P10636 3/20 0.39
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
HPGD P15428 2/20 0.37

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
SCHEMBL9058235 0.83 MAPT (0.38) RAB9AALDH1A1SMN1; SMN2GAAMAPT
SCHEMBL5702000 0.82 PI4KB (0.40) KDM4ENPC1RAB9AALDH1A1LMNA
SCHEMBL9058236 0.80 SMN1; SMN2 (0.35) ALDH1A1LMNASMN1; SMN2GAAMAPT
SCHEMBL8594445 0.79 GRM1 (0.37) KDM4EALDH1A1SMN1; SMN2GAAMAPT
SCHEMBL6953240 0.76 KMT2A (0.46) KDM4ENPC1RAB9AALDH1A1SMN1; SMN2
SCHEMBL8699278 0.74 KMT2A (0.42) KDM4ETHRBMAPK1ALDH1A1LMNA
SCHEMBL8700078 0.73 MAPT (0.56) KDM4ETHRBMAPK1ALDH1A1SMN1; SMN2
SCHEMBL8699435 0.72 RBP4 (0.49) KDM4EMAPK1ALDH1A1LMNAGAA
SCHEMBL8699464 0.72 MAPT (0.37) KDM4ENPC1RAB9AALDH1A1LMNA
SCHEMBL9266046 0.72 GAA (0.52) KDM4ENPC1RAB9AALDH1A1LMNA

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 3 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
EP-0749425-A1 NEW PIPERAZINE DERIVATIVES AND METHODS FOR THE PREPARATION THEREOF AND COMPOSITIONS CONTAINING THE SAME SAMJIN PHARM. CO., LTD. (KR) 1996-12-27 EP 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