SCHEMBL9675516

SCHEMBL9675516

CC(C)(C)[Si](C)(C)OCCc1cccc2[nH]c(C=O)nc12

nearest known ligand 0.34

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ DUT P33316 2/20 0.34
▸ BACE1 P56817 1/20 0.30
▸ ADAMTS5 Q9UNA0 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
SCHEMBL4715459 0.73 ADAMTS5 (0.33) ADAMTS5
SCHEMBL31145024 0.72 BACE1 (0.43) DUTBACE1
SCHEMBL10958983 0.72 BACE1 (0.43) DUTBACE1
SCHEMBL6527128 0.72 BACE1 (0.38) DUTBACE1
SCHEMBL23782284 0.71 GNRHR (0.36) ADAMTS5
SCHEMBL7754786 0.71 BACE1 (0.37) DUTBACE1
SCHEMBL1247159 0.71 BACE1 (0.37) DUTBACE1
SCHEMBL17398862 0.71 ALDH1A1 (0.42) DUTBACE1
SCHEMBL5736393 0.70 DUT (0.34) DUT
SCHEMBL6518418 0.70 CA1 (0.43) DUTBACE1

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-0276942-B1 6-BETA(SUBSTITUTED)-(S)-HYDROXYMETHYLPENICILLANIC ACIDS AND DERIVATIVES THEREOF PFIZER INC. (US) 1992-04-01 — — EP disclosed
US-4782050-A BACTERICIDES PFIZER INC. (US) 1988-11-01 — — US disclosed
EP-0276942-A1 6-Beta(substituted)-(S)-hydroxymethylpenicillanic acids and derivatives thereof PFIZER INC. (US) 1988-08-03 — — EP disclosed
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