SCHEMBL9307830

SCHEMBL9307830

C=CCOP(=O)(OCC=C)C(=C)C(=O)O

nearest known ligand 0.33

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
PKM P14618 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
PEPD P12955 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
SCHEMBL11649999 0.80 PKM (0.35) PKMSMN1; SMN2
SCHEMBL28766345 0.78 LPAR2 (0.33)
SCHEMBL7576649 0.76 PKM (0.31) PKMSMN1; SMN2
SCHEMBL16987216 0.74 TSHR (0.33) PKMSMN1; SMN2
SCHEMBL11308533 0.74 BTN3A1 (0.31)
SCHEMBL11681266 0.74 MAPT (0.37) PKMSMN1; SMN2
SCHEMBL18177935 0.72 CYP3A4 (0.38) PKMSMN1; SMN2
Methacrylic Acid SCHEMBL3464507 0.72 FNTA (0.40) PKMSMN1; SMN2PEPD
SCHEMBL1443576 0.71 PEPD (0.34) PEPD
SCHEMBL11682393 0.71 ALDH1A1 (0.33) PKMSMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0601573-A1 Alpha-phosphonocarboxylate squalene synthetase inhibitors and method BRISTOL-MYERS SQUIBB COMPANY (US) 1994-06-15 EP disclosed
US-5312814-A Antilipemic agents or anticholesterol agents BRISTOL-MYERS SQUIBB CO. (US) 1994-05-17 US disclosed