SCHEMBL9740834

SCHEMBL9740834

COC(=O)C(C)CO[PH2]=O

nearest known ligand 0.37

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ SMN1; SMN2 Q16637 2/20 0.37
▸ CA14 Q9ULX7 3/20 0.34
▸ TSHR P16473 3/20 0.33
▸ CA12 O43570 2/20 0.32
▸ HSD17B10 Q99714 1/20 0.32
▸ CA1 P00915 1/20 0.31
▸ CA2 P00918 1/20 0.31
▸ ESRRB O95718 1/20 0.31
▸ ALDH1A1 P00352 1/20 0.31
▸ CA7 P43166 1/20 0.30
▸ CA9 Q16790 1/20 0.30

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
SCHEMBL15910174 0.77 SMN1; SMN2 (0.42) SMN1; SMN2CA14TSHRCA12HSD17B10
SCHEMBL445678 0.77 — —
SCHEMBL10125303 0.77 — —
SCHEMBL14680929 0.77 — —
SCHEMBL12135801 0.73 SMN1; SMN2 (0.39) SMN1; SMN2CA14TSHRCA12HSD17B10
SCHEMBL3892276 0.73 — —
SCHEMBL10272235 0.73 SMN1; SMN2 (0.39) SMN1; SMN2CA14TSHRCA12HSD17B10
SCHEMBL13057735 0.73 SMN1; SMN2 (0.39) SMN1; SMN2CA14TSHRCA12HSD17B10
SCHEMBL12135807 0.73 SMN1; SMN2 (0.39) SMN1; SMN2CA14TSHRCA12HSD17B10
SCHEMBL445988 0.73 SMN1; SMN2 (0.39) SMN1; SMN2CA14TSHRCA12HSD17B10

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0413762-A4 PEPTIDE ANALOGS AND THEIR USE AS HAPTENS TO ELICIT CATALYTIC ANTIBODIES — 1992-01-15 — — EP disclosed
EP-0413762-A1 PEPTIDE ANALOGS AND THEIR USE AS HAPTENS TO ELICIT CATALYTIC ANTIBODIES IGEN, INCORPORATED (US) 1991-02-27 — — EP disclosed
WO-1989010961-A1 PEPTIDE ANALOGS AND THEIR USE AS HAPTENS TO ELICIT CATALYTIC ANTIBODIES IGEN, INC. (US) 1989-11-16 — — WO disclosed
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