SCHEMBL2708989

SCHEMBL2708989

CCN(C(C)C(=O)OC(C)(C)C)[C@H](C)C(=O)OCc1ccccc1

nearest known ligand 0.48

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.48
SYK P43405 1/20 0.47
ALDH1A1 P00352 2/20 0.44
SMN1; SMN2 Q16637 1/20 0.40
GAA P10253 1/20 0.40
NTSR1 P30989 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
SCHEMBL2140318 1.00 POLB (0.48) POLBSYKALDH1A1SMN1; SMN2GAA
SCHEMBL20272638 0.84 ALDH1A1 (0.50) ALDH1A1
SCHEMBL30863382 0.81 ABCB1 (0.49) POLBSYKALDH1A1SMN1; SMN2
SCHEMBL30878162 0.81 POLB (0.47) POLBSYKALDH1A1SMN1; SMN2
SCHEMBL19456479 0.81 POLB (0.47) POLBSYKALDH1A1SMN1; SMN2NTSR1
SCHEMBL30307663 0.81 POLB (0.47) POLBSYKALDH1A1SMN1; SMN2
SCHEMBL2499502 0.81 POLB (0.47) POLBSYKALDH1A1SMN1; SMN2
SCHEMBL2136696 0.81 POLB (0.46) POLBSYKALDH1A1GAANTSR1
SCHEMBL2138277 0.81 POLB (0.46) POLBSYKALDH1A1GAANTSR1
SCHEMBL12345526 0.80 ALDH1A1 (0.51) POLBSYKALDH1A1

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-2447265-A1 NOVEL THIOPHENE CARBOXAMIDE DERIVATIVE AND MEDICINAL USE OF SAME Sanwa Kagaku Kenkyusho Co., Ltd (JP) 2012-05-02 EP disclosed