SCHEMBL6465870

SCHEMBL6465870

CC(C)OC(=O)Nc1cc[c]c(Cl)c1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 2/20 0.60
ALOX15 P16050 1/20 0.60
KDM4E B2RXH2 1/20 0.54
SMN1; SMN2 Q16637 3/20 0.49
RAB9A P51151 3/20 0.49
CYP1A2 P05177 2/20 0.49
CYP2C9 P11712 2/20 0.49
CYP2C19 P33261 2/20 0.49
NPC1 O15118 2/20 0.49
CYP2D6 P10635 1/20 0.49
MAPT P10636 4/20 0.46
HTT P42858 3/20 0.46
LMNA P02545 1/20 0.46
MEN1 O00255 2/20 0.45
KMT2A Q03164 2/20 0.45
TSHR P16473 1/20 0.45
MAPK1 P28482 1/20 0.45
TDP1 Q9NUW8 1/20 0.44
AGPAT2 O15120 1/20 0.41
RORC P51449 1/20 0.38

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
SCHEMBL6501890 0.80 CA12 (0.45) MEN1KMT2A
SCHEMBL6502508 0.79 KDM4E (0.51) HPGDKDM4ESMN1; SMN2RAB9ACYP1A2
SCHEMBL2358907 0.77 SMN1; SMN2 (0.62) HPGDALOX15KDM4ESMN1; SMN2RAB9A
SCHEMBL2459851 0.77 ALDH1A1 (0.47) KDM4ESMN1; SMN2RAB9ACYP1A2NPC1
SCHEMBL10608407 0.76 HTT (0.71) HPGDALOX15KDM4ESMN1; SMN2RAB9A
Chlorpropham SCHEMBL54464 0.75 HPGD (1.00) HPGDALOX15KDM4ESMN1; SMN2RAB9A
Chlorpropham SCHEMBL22437601 0.75 HPGD (1.00) HPGDALOX15KDM4ESMN1; SMN2RAB9A
Chlorpropham SCHEMBL8538082 0.75 HPGD (1.00) HPGDALOX15KDM4ESMN1; SMN2RAB9A
SCHEMBL10344871 0.74 L3MBTL1 (0.55) KDM4ERAB9ANPC1MAPTHTT
SCHEMBL15143918 0.74 SMN1; SMN2 (0.79) HPGDALOX15KDM4ESMN1; SMN2RAB9A

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-2005082414-A2 CONCOMITANT DRUGS OF A SULFONAMIDE AND ANOTHER THERAPEUTIC AGENT ASTELLAS PHARMA INC. (JP) 2005-09-09 WO disclosed