SCHEMBL17145160

SCHEMBL17145160

CCOC(=O)C1=C[C@H]2O[C@H]2[C@H](OCOC)C1

nearest known ligand 0.37

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.33
TSHR P16473 3/20 0.33
MEN1 O00255 2/20 0.33
KMT2A Q03164 2/20 0.33
CYP3A4 P08684 2/20 0.33
ALDH1A1 P00352 5/20 0.33
KDM4E B2RXH2 4/20 0.33
HSD17B10 Q99714 3/20 0.33
HPGD P15428 3/20 0.33
GAA P10253 1/20 0.33
GLA P06280 1/20 0.32
ALOX15 P16050 2/20 0.32
USP2 O75604 1/20 0.32
PKM P14618 1/20 0.32
ALOX12 P18054 1/20 0.32
MAPT P10636 2/20 0.31
HTT P42858 2/20 0.31
PPM1B O75688 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31

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
SCHEMBL14905974 0.88 MAPT (0.30) TSHRKMT2AHSD17B10MAPT
SCHEMBL15970003 0.88 MAPT (0.30) TSHRKMT2AHSD17B10MAPT
SCHEMBL17145154 0.78 LMNA (0.37) LMNATSHRMEN1KMT2ACYP3A4
SCHEMBL3455790 0.69 LMNA (0.44) LMNATSHRMEN1KMT2ACYP3A4
SCHEMBL3679243 0.68 KMT2A (0.34) LMNAMEN1KMT2ACYP3A4ALDH1A1
SCHEMBL10478110 0.67 LMNA (0.44) LMNATSHRMEN1KMT2ACYP3A4
SCHEMBL30468216 0.67 TSHR (0.35) LMNATSHRMEN1KMT2ACYP3A4
SCHEMBL12761885 0.66 KDM4E (0.31) LMNAALDH1A1KDM4EHPGDGLA
SCHEMBL1255126 0.66 KDM4E (0.31) LMNAALDH1A1KDM4EHPGDGLA
SCHEMBL14905975 0.66 CHRM3 (0.30)

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
US-9150498-B2 Process for the preparation of oseltamivir and methyl 3-epi-shikimate COUNCIL OF SCIENTIFIC & INDUSTRIAL RESEARCH (IN) 2015-10-06 US disclosed