SCHEMBL24371819

SCHEMBL24371819

CC1(C)OC2[C@H](O1)O[C@](CO)(COCc1ccccc1)[C@@H]2OCc1ccccc1

nearest known ligand 0.45

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.37
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
TSHR P16473 1/20 0.33
GSTP1 P09211 2/20 0.32
PDE4D Q08499 2/20 0.32
IDO1 P14902 1/20 0.32
TAAR1 Q96RJ0 1/20 0.32
CHRNB2 P17787 1/20 0.31
CHRNB4 P30926 1/20 0.31
CHRNA3 P32297 1/20 0.31
CHRNA4 P43681 1/20 0.31
KDM4E B2RXH2 1/20 0.31
POLB P06746 1/20 0.31
GLB1 P16278 1/20 0.30
TACR1 P25103 1/20 0.30
BCHE P06276 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
SCHEMBL29189662 1.00 ALDH1A1 (0.37) ALDH1A1MEN1KMT2ATSHRGSTP1
SCHEMBL20406042 1.00 ALDH1A1 (0.37) ALDH1A1MEN1KMT2ATSHRGSTP1
SCHEMBL13382976 1.00 ALDH1A1 (0.37) ALDH1A1MEN1KMT2ATSHRGSTP1
SCHEMBL1059672 1.00 ALDH1A1 (0.37) ALDH1A1MEN1KMT2ATSHRGSTP1
SCHEMBL24498686 1.00 ALDH1A1 (0.37) ALDH1A1MEN1KMT2ATSHRGSTP1
SCHEMBL18999217 1.00 ALDH1A1 (0.37) ALDH1A1MEN1KMT2ATSHRGSTP1
SCHEMBL2512944 1.00 ALDH1A1 (0.37) ALDH1A1MEN1KMT2ATSHRGSTP1
SCHEMBL19221818 1.00 ALDH1A1 (0.37) ALDH1A1MEN1KMT2ATSHRGSTP1
SCHEMBL21063154 1.00 ALDH1A1 (0.37) ALDH1A1MEN1KMT2ATSHRGSTP1
SCHEMBL1096431 1.00 ALDH1A1 (0.37) ALDH1A1MEN1KMT2ATSHRGSTP1

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
EP-3043803-B1 NUCLEOTIDE AND NUCLEOSIDE COMPOSITIONS AND THEIR USES UNIV EMORY (US) 2022-04-27 EP disclosed