SCHEMBL8763293

SCHEMBL8763293

C=C(C)COCC(O)CN(C)CC

nearest known ligand 0.32

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
HTT P42858 1/20 0.32
HSD17B10 Q99714 1/20 0.31
LMNA P02545 1/20 0.31
USP2 O75604 1/20 0.30

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
SCHEMBL8763177 0.84 LMNA (0.43) HSD17B10LMNAUSP2
SCHEMBL8762146 0.83 HIF1A (0.42) HTTLMNA
SCHEMBL11030769 0.80 ALDH1A1 (0.31) LMNA
SCHEMBL17933326 0.79 HSD17B10 (0.52) HTTHSD17B10LMNAUSP2
SCHEMBL15836120 0.79 HSD17B10 (0.37) HTTHSD17B10LMNAUSP2
SCHEMBL8764055 0.79 ALDH1A1 (0.38) HSD17B10LMNAUSP2
SCHEMBL201963 0.78 KDM4E (0.34) HSD17B10USP2
SCHEMBL16553158 0.77 KDM4E (0.35) HTTHSD17B10USP2
SCHEMBL4576292 0.76 ALDH1A1 (0.36) HSD17B10
SCHEMBL347663 0.76 KDM4E (0.38) HSD17B10

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
EP-0783589-A1 TRANSPORTABILITY IMPROVER FOR PULVERIZED COAL Kao Corporation (JP) 1997-07-16 EP disclosed
WO-1996010093-A1 TRANSPORTABILITY IMPROVER FOR PULVERIZED COAL KAO CORPORATION (JP) 1996-04-04 WO disclosed
US-4663061-A Metal-working oil composition KAO CORPORATION (JP) 1987-05-05 US disclosed