SCHEMBL10345487

SCHEMBL10345487

CC(C)(C)[Si](C)(C)N1C(=O)[C@H](Cc2ccccc2)[C@H]1C(=O)O

nearest known ligand 0.39

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
PPARG P37231 7/20 0.39
CYP2C9 P11712 6/20 0.39
PPARA Q07869 6/20 0.39
CYP3A4 P08684 4/20 0.39
KCNH2 Q12809 3/20 0.39
CES2 O00748 3/20 0.38
FOLH1 Q04609 5/20 0.38
LMNA P02545 1/20 0.37
CYP1A2 P05177 1/20 0.37
CYP2C19 P33261 1/20 0.37
RECQL P46063 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
NPSR1 Q6W5P4 1/20 0.37
CTRB1 P17538 1/20 0.35
CYP19A1 P11511 1/20 0.35
LTB4R Q15722 1/20 0.35
LTB4R2 Q9NPC1 1/20 0.35
ELANE P08246 1/20 0.35

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
SCHEMBL20302623 0.90 ELANE (0.38) PPARGCYP2C9PPARACYP3A4KCNH2
SCHEMBL13302641 0.82 F11 (0.39) PPARGCYP2C9PPARACYP3A4KCNH2
SCHEMBL15311053 0.80 MEN1 (0.32)
SCHEMBL14761931 0.80 MEN1 (0.32)
SCHEMBL7409013 0.80 ALDH1A1 (0.37) PPARALMNACYP2C19RECQLSMN1; SMN2
SCHEMBL20302314 0.78 KDM4E (0.39) ELANE
SCHEMBL25770150 0.78 F11 (0.37) PPARGCYP2C9PPARACYP3A4KCNH2
SCHEMBL8235565 0.77 ADAM17 (0.47) PPARGCYP2C9PPARACYP3A4KCNH2
SCHEMBL7402592 0.76 MME (0.31)
SCHEMBL16991870 0.75 SMN1; SMN2 (0.37) RECQLSMN1; 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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0171159-B1 SUBSTITUTED AZETIDINONE COMPOUNDS, THEIR PREPARATION, AND MEDICAMENTS CONTAINING THEM YAMANOUCHI PHARMACEUTICAL CO. LTD. (JP) 1990-05-30 EP disclosed
US-4719207-A CENTRAL NERVOUS SYSTEM YAMANOUCHI PHARMACEUTICAL CO., LTD. (JP) 1988-01-12 US disclosed
EP-0171159-A1 Substituted azetidinone compounds, their preparation, and medicaments containing them YAMANOUCHI PHARMACEUTICAL CO. LTD. (JP) 1986-02-12 EP disclosed