SCHEMBL7857951

SCHEMBL7857951

CC(C)(C)OC(=O)N(CCc1ccccc1)CC(=O)Nc1ccc2ccccc2c1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PSMB5 P28074 1/20 0.46
ALDH1A1 P00352 3/20 0.46
KDM4E B2RXH2 3/20 0.46
CYP1A2 P05177 2/20 0.46
MEN1 O00255 2/20 0.46
KMT2A Q03164 2/20 0.46
CYP2C19 P33261 1/20 0.46
HIF1A Q16665 1/20 0.46
POLB P06746 4/20 0.45
MAPT P10636 3/20 0.45
L3MBTL1 Q9Y468 1/20 0.45
RAB9A P51151 6/20 0.44
SMN1; SMN2 Q16637 3/20 0.44
GAA P10253 2/20 0.44
LMNA P02545 4/20 0.44
HTT P42858 3/20 0.44
NPC1 O15118 4/20 0.43
PLAU P00749 1/20 0.43
BACE1 P56817 1/20 0.42
TP53 P04637 1/20 0.42

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
SCHEMBL3050230 0.78 MEN1 (0.46) KDM4ECYP1A2MEN1KMT2APOLB
SCHEMBL7730448 0.77 HDAC1 (0.45) MEN1KMT2APOLBL3MBTL1RAB9A
SCHEMBL19339522 0.76 HPGD (0.50) PSMB5ALDH1A1MEN1KMT2APOLB
SCHEMBL3635901 0.76 LTA4H (0.56) ALDH1A1MEN1KMT2APOLBMAPT
SCHEMBL22421882 0.74 MEN1 (0.49) MEN1KMT2APOLBL3MBTL1RAB9A
SCHEMBL9823156 0.74 HDAC1 (0.54) MEN1KMT2AMAPTL3MBTL1RAB9A
SCHEMBL4781274 0.74 HDAC3 (0.48) ALDH1A1KDM4ECYP1A2MEN1KMT2A
SCHEMBL7860788 0.73 MC4R (0.48) PSMB5ALDH1A1KDM4ECYP1A2MEN1
SCHEMBL6717933 0.73 LTA4H (0.58) ALDH1A1MEN1KMT2APOLBMAPT
SCHEMBL4367428 0.73 AKT1 (0.48) ALDH1A1KDM4ECYP1A2MEN1KMT2A

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-6245746-B1 ADMINISTERING AMIDE MICROBIOCIDE ANTIBIOTIC MICROCIDE PHARMACEUTICALS, INC. 2001-06-12 US disclosed
US-6114310-A THERAPY FOR MICROBIAL INFECTIONS MICROCIDE PHARMACEUTICALS, INC. (US) 2000-09-05 US disclosed
WO-1999037667-A1 EFFLUX PUMP INHIBITORS MICROCIDE PHARMACEUTICALS, INC. (US) 1999-07-29 WO disclosed