SCHEMBL20247656

SCHEMBL20247656

C=C(OC)[C@H]1C[C@@H](C(=O)O)N(C(=O)OC(C)(C)C)C1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.39
BTK Q06187 1/20 0.37
CYP1A2 P05177 1/20 0.37
POLB P06746 1/20 0.37
CYP3A4 P08684 1/20 0.37
CYP2C19 P33261 1/20 0.37
HTRA1 Q92743 1/20 0.35
UCHL1 P09936 1/20 0.35
NR1H2 P55055 2/20 0.35
CHRM2 P08172 1/20 0.34
CHRM1 P11229 1/20 0.34
CHRM3 P20309 1/20 0.34
HSD11B1 P28845 1/20 0.34
F13A1 P00488 1/20 0.34
TGM2 P21980 1/20 0.34
TGM1 P22735 1/20 0.34
ATM Q13315 1/20 0.33
NR1H3 Q13133 1/20 0.32
PTPN1 P18031 1/20 0.32

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
SCHEMBL10592282 0.86 HSD17B10 (0.42) HSD17B10SMN1; SMN2BTKCYP1A2POLB
SCHEMBL17715161 0.86 HSD17B10 (0.42) HSD17B10SMN1; SMN2BTKCYP1A2POLB
SCHEMBL20212525 0.86 HSD17B10 (0.42) HSD17B10SMN1; SMN2BTKCYP1A2POLB
SCHEMBL7730850 0.86 HSD17B10 (0.42) HSD17B10SMN1; SMN2BTKCYP1A2POLB
SCHEMBL19853319 0.85 HSD17B10 (0.49) HSD17B10SMN1; SMN2BTKCYP1A2POLB
SCHEMBL19853293 0.85 HSD17B10 (0.49) HSD17B10SMN1; SMN2BTKCYP1A2POLB
SCHEMBL29015465 0.82 HSD17B10 (0.44) HSD17B10SMN1; SMN2BTKCYP1A2POLB
SCHEMBL29015468 0.82 HSD17B10 (0.44) HSD17B10SMN1; SMN2BTKCYP1A2POLB
SCHEMBL30402912 0.82 HSD17B10 (0.44) HSD17B10SMN1; SMN2BTKCYP1A2POLB
SCHEMBL10591305 0.81 HSD17B10 (0.43) HSD17B10SMN1; SMN2BTKCYP1A2POLB

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3431477-A1 CONDENSED IMIDAZOLYLIMIDAZOLES AS ANTIVIRAL COMPOUNDS Gilead Pharmasset LLC (US) 2019-01-23 EP disclosed
EP-2907816-B1 Condensed imidazolylimidazoles as antiviral compounds GILEAD PHARMASSET LLC (US) 2018-06-13 EP disclosed