SCHEMBL7064899

SCHEMBL7064899

CC(C)(CNC(=O)Nc1cccnc1Cl)CC(=O)N(CC(=O)NO)CC1CCCC1

nearest known ligand 0.40

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
OPRM1 P35372 1/20 0.39
SLC6A9 P48067 1/20 0.37
SMN1; SMN2 Q16637 3/20 0.37
HTT P42858 3/20 0.37
RAB9A P51151 5/20 0.36
KMT2A Q03164 4/20 0.36
MEN1 O00255 3/20 0.36
GAA P10253 1/20 0.36
ALDH1A1 P00352 4/20 0.36
NPC1 O15118 3/20 0.36
LMNA P02545 1/20 0.36
MAPT P10636 1/20 0.36
CXCR2 P25025 4/20 0.34
MAPK1 P28482 1/20 0.34

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
SCHEMBL6825098 0.88 HDAC1 (0.47) SMN1; SMN2HTTKMT2AMEN1LMNA
SCHEMBL7065659 0.88 HDAC1 (0.47) SMN1; SMN2HTTKMT2AMEN1LMNA
SCHEMBL6827642 0.88 NPC1 (0.38) RAB9ANPC1
SCHEMBL6822311 0.88 NPC1 (0.40) RAB9ANPC1
SCHEMBL7069145 0.88 P2RX7 (0.44) SMN1; SMN2HTTKMT2AMEN1ALDH1A1
SCHEMBL6824917 0.87 KDM4E (0.35) SLC6A9RAB9AGAANPC1
SCHEMBL6825617 0.85 NPC1 (0.42) OPRM1SLC6A9SMN1; SMN2HTTRAB9A
SCHEMBL6825944 0.84 KMT2A (0.43) RAB9AKMT2AMEN1GAANPC1
SCHEMBL6822302 0.84 KMT2A (0.40) SMN1; SMN2RAB9AKMT2AMEN1ALDH1A1
SCHEMBL6822127 0.84 KMT2A (0.44) SMN1; SMN2RAB9AKMT2AMEN1GAA

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2004087643-A1 DEFORMYLASE INHIBITOR, PROCESS FOR PREPARING THE SAME, AND ANTIBACTERIAL COMPOSITION COMPRISING THE SAME PROMEDITECH INC. (KR) 2004-10-14 WO disclosed