SCHEMBL8575697

SCHEMBL8575697

CC(C)OC(=O)CCc1ccccc1N1CC(=O)NC1=O

nearest known ligand 0.44

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
NOTUM Q6P988 1/20 0.44
ALDH1A1 P00352 2/20 0.42
HSD17B10 Q99714 2/20 0.42
HPGD P15428 2/20 0.42
KDM4E B2RXH2 1/20 0.42
AGTR1 P30556 1/20 0.41
MAPT P10636 4/20 0.39
MEN1 O00255 3/20 0.39
KMT2A Q03164 3/20 0.39
LMNA P02545 1/20 0.39
TSHR P16473 2/20 0.39
ALOX15 P16050 1/20 0.37
CASP1 P29466 1/20 0.37
CASP7 P55210 1/20 0.37
FAAH O00519 3/20 0.37
TDP1 Q9NUW8 3/20 0.36
POLB P06746 1/20 0.36
USP2 O75604 1/20 0.35

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
SCHEMBL8414043 0.82 NOTUM (0.46) NOTUMALDH1A1HSD17B10HPGDKDM4E
SCHEMBL8575701 0.79 FAAH (0.40) NOTUMALDH1A1HSD17B10HPGDKDM4E
SCHEMBL2191985 0.75 LMNA (0.58) MAPTMEN1KMT2ALMNATSHR
SCHEMBL14360117 0.71 TSHR (0.49) NOTUMALDH1A1HSD17B10HPGDKDM4E
SCHEMBL30410323 0.71 TSHR (0.49) NOTUMALDH1A1HSD17B10HPGDKDM4E
SCHEMBL27613400 0.70 ALDH1A1 (0.48) NOTUMALDH1A1HSD17B10HPGDKDM4E
Hydrochloric Acid SCHEMBL8414091 0.69 ALDH1A1 (0.39) NOTUMALDH1A1HSD17B10HPGDKDM4E
SCHEMBL1470873 0.69 FFAR4 (0.46) NOTUMALDH1A1HSD17B10HPGDKDM4E
SCHEMBL18591613 0.68 LMNA (0.56) NOTUMALDH1A1HSD17B10HPGDKDM4E
SCHEMBL8558186 0.68 NOTUM (0.42) NOTUMALDH1A1HSD17B10HPGDKDM4E

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
US-5852192-A Cyclic urea derivatives, pharmaceutical compositions containing these compounds and processes for preparing them DR. KARL THOMAE GMBH (DE) 1998-12-22 US disclosed