SCHEMBL20047092

SCHEMBL20047092

CC#CCN1CCOCCOCCOCC1

nearest known ligand 0.52

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.52
RECQL P46063 1/20 0.52
POLB P06746 1/20 0.47
GAA P10253 1/20 0.47
KDM4E B2RXH2 3/20 0.41
HSD17B10 Q99714 1/20 0.40
LMNA P02545 1/20 0.40
GLA P06280 1/20 0.38
HTT P42858 1/20 0.38
USP2 O75604 1/20 0.38
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
KEAP1 Q14145 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37

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
SCHEMBL7146048 1.00 ALDH1A1 (0.52) ALDH1A1RECQLPOLBGAAKDM4E
SCHEMBL6929250 0.85 POLB (0.59) ALDH1A1RECQLPOLBGAAKDM4E
SCHEMBL1745361 0.80 ALDH1A1 (0.66) ALDH1A1RECQLPOLBGAAKDM4E
SCHEMBL12374731 0.79 ALDH1A1 (0.50) ALDH1A1RECQLPOLBGAAKDM4E
SCHEMBL17392944 0.79 POLB (0.50) ALDH1A1RECQLPOLBGAAKDM4E
SCHEMBL6930770 0.78 LMNA (0.70) ALDH1A1RECQLPOLBGAAKDM4E
SCHEMBL14083741 0.77 ALDH1A1 (0.43) ALDH1A1RECQLKDM4EHSD17B10GLA
SCHEMBL4011716 0.77
SCHEMBL19886703 0.77
SCHEMBL23085722 0.76 ALDH1A1 (0.47) ALDH1A1RECQLPOLBGAAKDM4E

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
WO-2018067615-A1 COMPOUNDS, DEVICES, AND USES THEREOF SIGILON THERAPEUTICS, INC. (US) 2018-04-12 WO disclosed