SCHEMBL10695049

SCHEMBL10695049

COC(=O)C(C)C[PH](=O)O

nearest known ligand 0.38

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.38
CA14 Q9ULX7 3/20 0.35
CA12 O43570 2/20 0.33
MME P08473 1/20 0.33
CA1 P00915 1/20 0.32
CA2 P00918 1/20 0.32
ESRRB O95718 1/20 0.32
CA7 P43166 1/20 0.31
CA9 Q16790 1/20 0.31
ZDHHC7 Q9NXF8 1/20 0.31

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
SCHEMBL31516115 0.80 ALDH1A1 (0.39) SMN1; SMN2
SCHEMBL2403903 0.80 SMN1; SMN2 (0.37) SMN1; SMN2CA14CA12MMECA1
SCHEMBL14353547 0.78 SMN1; SMN2 (0.35) SMN1; SMN2CA14CA12MMECA1
SCHEMBL5535077 0.77 ALDH1A1 (0.33)
SCHEMBL14354416 0.75 SMN1; SMN2 (0.33) SMN1; SMN2CA14
Hydrochloric Acid SCHEMBL9797867 0.74 SMN1; SMN2 (0.33) SMN1; SMN2CA1CA2
SCHEMBL1387254 0.73
SCHEMBL5701101 0.73
SCHEMBL10487218 0.72 SMN1; SMN2 (0.32) SMN1; SMN2
SCHEMBL24072865 0.72 SMN1; SMN2 (0.46) SMN1; SMN2CA14CA12MMECA1

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-0266978-A2 Novel antibacterial agents and potentiators of carbapenem antibiotics MERCK & CO. INC. (US) 1988-05-11 EP disclosed