SCHEMBL6530767

SCHEMBL6530767

CCOC(=O)C1OC(C)(C)OC1C(=O)O

nearest known ligand 0.61

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.44
LMNA P02545 2/20 0.41
PPM1B O75688 1/20 0.41
PTPN1 P18031 1/20 0.41
PPP1CC P36873 1/20 0.41
POLB P06746 1/20 0.36
GAA P10253 1/20 0.36
HCAR2 Q8TDS4 1/20 0.34
ALDH1A1 P00352 4/20 0.33
NPSR1 Q6W5P4 1/20 0.33
PGD P52209 1/20 0.33
KMT2A Q03164 2/20 0.33
MEN1 O00255 1/20 0.33
HSD17B10 Q99714 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
SCHEMBL24066052 1.00 TSHR (0.44) TSHRLMNAPPM1BPTPN1PPP1CC
SCHEMBL27159733 1.00 TSHR (0.44) TSHRLMNAPPM1BPTPN1PPP1CC
SCHEMBL28544198 1.00 TSHR (0.44) TSHRLMNAPPM1BPTPN1PPP1CC
SCHEMBL29183553 1.00 TSHR (0.44) TSHRLMNAPPM1BPTPN1PPP1CC
SCHEMBL21001793 1.00 TSHR (0.44) TSHRLMNAPPM1BPTPN1PPP1CC
SCHEMBL805599 0.92 TSHR (0.44) TSHRLMNAPPM1BPTPN1PPP1CC
SCHEMBL2749084 0.92 TSHR (0.44) TSHRLMNAPPM1BPTPN1PPP1CC
SCHEMBL13422928 0.92 TSHR (0.44) TSHRLMNAPPM1BPTPN1PPP1CC
SCHEMBL30828899 0.92 TSHR (0.44) TSHRLMNAPPM1BPTPN1PPP1CC
SCHEMBL12540224 0.85 LMNA (0.41) TSHRLMNAPPM1BPTPN1PPP1CC

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
CN-111542523-B Heterocyclic compounds as PRMT5 inhibitors 朱比连特埃皮斯科瑞有限责任公司 2024-03-29 CN disclosed
WO-2005082892-A2 TRIAZOLE COMPOUNDS AS ANTIBACTERIAL AGENTS AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM DR. REDDY'S LABORATORIES LTD. (IN) 2005-09-09 WO disclosed