SCHEMBL29039402

SCHEMBL29039402

CC(C)(C)OC(=O)CCOCC1CCCN1C(=O)OC(C)(C)C

nearest known ligand 0.43

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 1/20 0.41
ALOX5AP P20292 1/20 0.41
FEN1 P39748 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.40
ALDH1A1 P00352 1/20 0.39
PDE8B O95263 1/20 0.38
OPRD1 P41143 1/20 0.38
ATM Q13315 2/20 0.38
NPC1 O15118 1/20 0.37
FPR3 P25089 1/20 0.37
FPR2 P25090 1/20 0.37
TSHR P16473 1/20 0.36

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
SCHEMBL26725270 1.00 HSD17B10 (0.41) HSD17B10ALOX5APFEN1SMN1; SMN2ALDH1A1
SCHEMBL21530355 0.92 SMN1; SMN2 (0.41) HSD17B10ALOX5APFEN1SMN1; SMN2ALDH1A1
SCHEMBL21530356 0.92 SMN1; SMN2 (0.41) HSD17B10ALOX5APFEN1SMN1; SMN2ALDH1A1
SCHEMBL20399892 0.92 SMN1; SMN2 (0.41) HSD17B10ALOX5APFEN1SMN1; SMN2ALDH1A1
SCHEMBL25254934 0.90 HSD17B10 (0.36) HSD17B10ALOX5APFEN1SMN1; SMN2ALDH1A1
SCHEMBL20399345 0.90 HSD17B10 (0.44) HSD17B10ALOX5APFEN1SMN1; SMN2ALDH1A1
SCHEMBL20399344 0.90 HSD17B10 (0.44) HSD17B10ALOX5APFEN1SMN1; SMN2ALDH1A1
SCHEMBL29039261 0.86 HSD17B10 (0.43) HSD17B10ALOX5APFEN1SMN1; SMN2ALDH1A1
SCHEMBL3771067 0.86 HSD17B10 (0.43) HSD17B10ALOX5APFEN1SMN1; SMN2ALDH1A1
SCHEMBL31452738 0.86 HSD17B10 (0.43) HSD17B10ALOX5APFEN1SMN1; SMN2ALDH1A1

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
CN-116234802-A Quinoline CGAS antagonist compounds 免疫传感器治疗股份有限公司 2023-06-06 CN disclosed