SCHEMBL10500652

SCHEMBL10500652

CC(/C=C\Sc1ccc(Cl)cc1)O[Si](C)(C)C(C)(C)C

nearest known ligand 0.30

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.30
LMNA P02545 1/20 0.30
MAPT P10636 1/20 0.30
NPSR1 Q6W5P4 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
SCHEMBL10500661 1.00 ALDH1A1 (0.30) ALDH1A1LMNAMAPTNPSR1
SCHEMBL8825724 1.00 ALDH1A1 (0.30) ALDH1A1LMNAMAPTNPSR1
SCHEMBL8825721 1.00 ALDH1A1 (0.30) ALDH1A1LMNAMAPTNPSR1
SCHEMBL8826057 0.87 MEN1 (0.33) ALDH1A1LMNAMAPTNPSR1
SCHEMBL8826055 0.87 MEN1 (0.33) ALDH1A1LMNAMAPTNPSR1
SCHEMBL8825842 0.85 PLIN1 (0.32) ALDH1A1LMNAMAPTNPSR1
SCHEMBL8825947 0.85 PLIN1 (0.32) ALDH1A1LMNAMAPTNPSR1
SCHEMBL9118305 0.85 PLIN1 (0.32) ALDH1A1LMNAMAPTNPSR1
SCHEMBL8826045 0.84 CYP1A1 (0.36) ALDH1A1
SCHEMBL10500521 0.84 CYP1A1 (0.36) ALDH1A1

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
US-4816581-A 4-(phenylthio or phenylsulfonyl) azetidinones and process of manufacture HOFFMAN-LA ROCHE INC. (US) 1989-03-28 US disclosed
EP-0179318-B1 STERICAL UNIFORM 2-AZETIDINONES F. HOFFMANN-LA ROCHE & CO. Aktiengesellschaft (CH) 1989-01-18 EP disclosed
EP-0179318-A1 Sterical uniform 2-azetidinones F. HOFFMANN-LA ROCHE & CO. Aktiengesellschaft (CH) 1986-04-30 EP disclosed