SCHEMBL7269288

SCHEMBL7269288

CC(C)(C)OC(=O)COC(=O)c1ccc2c(c1)NC(=O)CO2

nearest known ligand 0.57

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MAPT P10636 8/20 0.57
ALDH1A1 P00352 6/20 0.56
POLB P06746 1/20 0.56
SMN1; SMN2 Q16637 3/20 0.56
LMNA P02545 2/20 0.56
USP2 O75604 1/20 0.56
TSHR P16473 1/20 0.56
MAPK1 P28482 1/20 0.56
CASP3 P42574 1/20 0.55
SENP7 Q9BQF6 1/20 0.55
GAA P10253 1/20 0.55
NPSR1 Q6W5P4 1/20 0.53
RXFP1 Q9HBX9 1/20 0.53
KDM4E B2RXH2 1/20 0.53

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
SCHEMBL5658389 0.83 ALDH1A1 (0.59) MAPTALDH1A1SMN1; SMN2LMNANPSR1
SCHEMBL2954111 0.82 MAPT (0.62) MAPTALDH1A1POLBSMN1; SMN2LMNA
SCHEMBL19023499 0.78 MAPT (0.52) MAPTALDH1A1POLBSMN1; SMN2LMNA
SCHEMBL29901720 0.78 ALDH1A1 (0.63) MAPTALDH1A1POLBLMNATSHR
SCHEMBL6752 0.78 ALDH1A1 (0.63) MAPTALDH1A1POLBLMNATSHR
SCHEMBL7270318 0.76 GAA (0.59) MAPTALDH1A1POLBLMNAUSP2
SCHEMBL4295708 0.74 ALDH1A1 (0.61) MAPTALDH1A1POLBSMN1; SMN2LMNA
SCHEMBL352186 0.74 ALDH1A1 (0.68) MAPTALDH1A1POLBLMNATSHR
SCHEMBL4295310 0.74 ALDH1A1 (0.64) MAPTALDH1A1SMN1; SMN2LMNACASP3
SCHEMBL29195060 0.73 MAPT (0.75) MAPTALDH1A1POLBSMN1; SMN2LMNA

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-0411751-A1 Renin inhibitory peptides Beecham Group p.l.c. (GB) 1991-02-06 EP disclosed