SCHEMBL9544372

SCHEMBL9544372

CCCCOC(=O)N1CC(O)C[C@H]1C(=O)OCc1ccccc1

nearest known ligand 0.53

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.53
MAPK1 P28482 2/20 0.48
L3MBTL1 Q9Y468 2/20 0.48
ALDH1A1 P00352 1/20 0.48
CYP3A4 P08684 1/20 0.48
TSHR P16473 1/20 0.48
TDP1 Q9NUW8 1/20 0.48
ECE1 P42892 1/20 0.43
FKBP1A P62942 6/20 0.43
PRCP P42785 1/20 0.41
KDM4E B2RXH2 2/20 0.40
LMNA P02545 1/20 0.40
CHRM2 P08172 1/20 0.40
CHRM4 P08173 1/20 0.40
CHRM5 P08912 1/20 0.40
CHRM1 P11229 1/20 0.40
CHRM3 P20309 1/20 0.40
TMEM97 Q5BJF2 1/20 0.40
SIGMAR1 Q99720 1/20 0.40

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
SCHEMBL9544370 1.00 POLB (0.53) POLBMAPK1L3MBTL1ALDH1A1CYP3A4
SCHEMBL8863233 0.96 POLB (0.56) POLBMAPK1L3MBTL1ALDH1A1CYP3A4
SCHEMBL23485199 0.88 POLB (0.61) POLBALDH1A1FKBP1A
SCHEMBL2678864 0.88 POLB (0.61) POLBALDH1A1FKBP1A
SCHEMBL7433978 0.88 POLB (0.61) POLBALDH1A1FKBP1A
SCHEMBL30564487 0.88 POLB (0.61) POLBALDH1A1FKBP1A
SCHEMBL6017192 0.87 TSHR (0.52) POLBMAPK1L3MBTL1ALDH1A1CYP3A4
SCHEMBL7310404 0.86 POLB (0.62) POLBL3MBTL1ALDH1A1TSHRFKBP1A
SCHEMBL8482480 0.86 POLB (0.62) POLBL3MBTL1ALDH1A1TSHRFKBP1A
SCHEMBL8477557 0.86 POLB (0.62) POLBL3MBTL1ALDH1A1TSHRFKBP1A

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-1993017681-A1 ANGIOTENSIN II RECEPTOR ANTAGONISTS ABBOTT LABORATORIES (US) 1993-09-16 WO disclosed