SCHEMBL5599211

SCHEMBL5599211

O=C(O)Nc1ccccc1C1CCC1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 1/20 0.51
RIPK1 Q13546 1/20 0.45
ALDH1A1 P00352 2/20 0.44
PTGDR2 Q9Y5Y4 1/20 0.43
KDM1A O60341 1/20 0.42
L3MBTL1 Q9Y468 2/20 0.41
MEN1 O00255 3/20 0.41
KMT2A Q03164 3/20 0.41
HTT P42858 2/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
TAS1R3 Q7RTX0 2/20 0.40
TAS1R1 Q7RTX1 2/20 0.40
NPSR1 Q6W5P4 1/20 0.40
ABCC1 P33527 1/20 0.39
CYP2C19 P33261 2/20 0.39
HPGD P15428 1/20 0.39
RBP4 P02753 1/20 0.39
CYP2D6 P10635 1/20 0.39
ITGB3 P05106 1/20 0.38
ITGB1 P05556 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
SCHEMBL5133970 0.95 HSD17B10 (0.50) HSD17B10RIPK1PTGDR2MEN1KMT2A
Hydrochloric Acid SCHEMBL11161743 0.93 HSD17B10 (0.49) HSD17B10RIPK1PTGDR2KDM1AMEN1
SCHEMBL8553355 0.85 HTR2C (0.53) HSD17B10RIPK1
SCHEMBL13326964 0.84 HSD17B10 (0.50) HSD17B10RIPK1ALDH1A1HTTSMN1; SMN2
SCHEMBL30752014 0.82 HSD17B10 (0.51) HSD17B10RIPK1PTGDR2KDM1AMEN1
SCHEMBL7515266 0.79 HSD17B10 (0.49) HSD17B10RIPK1ALDH1A1PTGDR2MEN1
SCHEMBL11161739 0.79 HSD17B10 (0.49) HSD17B10ALDH1A1PTGDR2KDM1AMEN1
SCHEMBL5620628 0.79 TYR (0.48) HSD17B10RIPK1SMN1; SMN2TAS1R3TAS1R1
SCHEMBL30751987 0.78 HSD17B10 (0.58) HSD17B10RIPK1ALDH1A1KDM1AMEN1
SCHEMBL28104033 0.77 PTGDR2 (0.49) HSD17B10ALDH1A1PTGDR2MEN1KMT2A

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-2007004032-A1 OXAZOLIDIONES CONTAINING CYCLOBUTANE AS ANTIBACTERIAL AGENTS PHARMACIA & UPJOHN COMPANY LLC (US) 2007-01-11 WO disclosed