SCHEMBL10876210

SCHEMBL10876210

CC(=O)N1CCN(c2ccc(C(=O)Cl)cc2)CC1

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GFER P55789 3/20 0.65
CASP6 P55212 1/20 0.65
MAPT P10636 9/20 0.59
KMT2A Q03164 5/20 0.59
MEN1 O00255 3/20 0.59
ALDH1A1 P00352 5/20 0.57
HPGD P15428 2/20 0.57
CYP2C9 P11712 1/20 0.57
CYP2C19 P33261 1/20 0.57
RAB9A P51151 3/20 0.55
NPC1 O15118 3/20 0.55
MAPK1 P28482 3/20 0.55
HSD17B10 Q99714 2/20 0.55
USP2 O75604 1/20 0.55
TP53 P04637 1/20 0.55
LMNA P02545 2/20 0.51
L3MBTL1 Q9Y468 1/20 0.51
GAA P10253 2/20 0.50
ALOX15 P16050 2/20 0.50
ALOX12 P18054 2/20 0.50

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
SCHEMBL1483566 0.86 MAPT (0.71) GFERCASP6MAPTKMT2AMEN1
SCHEMBL5226625 0.84 LMNA (0.51) MAPTKMT2AMEN1ALDH1A1HPGD
SCHEMBL14802425 0.84 GFER (0.67) GFERCASP6MAPTKMT2AMEN1
SCHEMBL12306045 0.83 LMNA (0.48) GFERCASP6MAPTKMT2AMEN1
SCHEMBL4985313 0.83 GFER (0.70) GFERCASP6MAPTKMT2AMEN1
SCHEMBL62896 0.82 NPC1 (0.63) GFERMAPTKMT2AALDH1A1RAB9A
SCHEMBL14276932 0.82 CASP6 (0.69) GFERCASP6MAPTKMT2AMEN1
Hydrochloric Acid SCHEMBL2970110 0.81 NPC1 (0.61) GFERMAPTKMT2AALDH1A1RAB9A
Hydrochloric Acid SCHEMBL739845 0.81 NPC1 (0.61) GFERMAPTKMT2AALDH1A1RAB9A
SCHEMBL1128293 0.80 GFER (0.71) GFERCASP6MAPTKMT2AMEN1

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
JP-61037783-A None JP disclosed
JP-S6137783-A 1,3-DIOXALANE ACYLATE DERIVATIVE, AND ITS PREPARATION SUZUKI HIROYUKI 1986-02-22 JP disclosed
JP-S06137783-A 0001-01-01 JP disclosed