SCHEMBL7164659

SCHEMBL7164659

CCOC(=O)CCN(C(=O)Oc1cnc2sc(COC)nc2c1)c1ccccc1

nearest known ligand 0.41

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.41
TSHR P16473 1/20 0.36
MAPT P10636 2/20 0.35
ATM Q13315 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
CYSLTR2 Q9NS75 2/20 0.35
CYSLTR1 Q9Y271 2/20 0.35
PPARG P37231 2/20 0.35
PPARD Q03181 1/20 0.35
PPARA Q07869 1/20 0.35
POLB P06746 1/20 0.35
NPSR1 Q6W5P4 1/20 0.34
KMT2A Q03164 2/20 0.34
MEN1 O00255 1/20 0.34
GAA P10253 1/20 0.34
LTA4H P09960 2/20 0.34
GALR3 O60755 1/20 0.33

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
SCHEMBL6779045 0.86 SMN1; SMN2 (0.43) SMN1; SMN2TSHRMAPTL3MBTL1CYSLTR2
SCHEMBL7159095 0.86 SMN1; SMN2 (0.43) SMN1; SMN2TSHRMAPTATML3MBTL1
SCHEMBL7167893 0.82 ALDH1A1 (0.37) SMN1; SMN2TSHRMAPTL3MBTL1POLB
Hydrochloric Acid SCHEMBL7167303 0.81 NQO2 (0.48)
SCHEMBL7164317 0.76 SMN1; SMN2 (0.43) SMN1; SMN2MAPTL3MBTL1POLBKMT2A
SCHEMBL6779548 0.75 SMN1; SMN2 (0.44) SMN1; SMN2MAPTL3MBTL1KMT2AMEN1
SCHEMBL7161779 0.70 L3MBTL1 (0.40) SMN1; SMN2MAPTL3MBTL1PPARDPOLB
SCHEMBL7163316 0.69 SMN1; SMN2 (0.37) SMN1; SMN2TSHRMAPTL3MBTL1POLB
SCHEMBL7169154 0.69 SMN1; SMN2 (0.37) SMN1; SMN2TSHRMAPTATML3MBTL1
SCHEMBL6781801 0.69 NQO2 (0.42) SMN1; SMN2POLBKMT2AMEN1

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-0966454-B1 DISUBSTITUTED BICYCLIC HETEROCYCLES, THEIR PRODUCTION AND USE AS MEDICAMENTS BOEHRINGER INGELHEIM PHARMA (DE) 2003-05-07 EP disclosed