SCHEMBL10749859

SCHEMBL10749859

CC(=O)N(C)C1CCCO1

nearest known ligand 0.34

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.34
ASGR1 P07306 1/20 0.34
LMNA P02545 2/20 0.33
PIK3CD O00329 1/20 0.33
SMN1; SMN2 Q16637 2/20 0.32
NPC1 O15118 1/20 0.32
HPGD P15428 1/20 0.32
MEN1 O00255 1/20 0.32
POLB P06746 1/20 0.30
USP2 O75604 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
SCHEMBL15500025 0.94 PIK3CD (0.33) KMT2AASGR1PIK3CD
SCHEMBL5319822 0.83 LMNA (0.33) KMT2ALMNASMN1; SMN2NPC1HPGD
SCHEMBL6061650 0.83 LMNA (0.33) KMT2ALMNASMN1; SMN2NPC1HPGD
SCHEMBL6293471 0.82 LMNA (0.33) KMT2ALMNASMN1; SMN2NPC1HPGD
SCHEMBL15814830 0.77 BCL2A1 (0.36) LMNA
SCHEMBL12711787 0.77 LMNA (0.31) LMNA
SCHEMBL6046429 0.75
SCHEMBL14297424 0.73 SMN1; SMN2 (0.33) ASGR1PIK3CDSMN1; SMN2
SCHEMBL1962258 0.73 NOS2 (0.36) SMN1; SMN2
SCHEMBL8170965 0.73

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-4656263-A 6-β-substituted penicillanic acid compound free of the 6-α-epimer PFIZER INC. (US) 1987-04-07 US disclosed
US-4518530-A 6-β-Substituted penicillanic acids as β-lactamase inhibitors PFIZER INC. (US) 1985-05-21 US disclosed
US-4517126-A Penicillanic acid derivative PFIZER INC. (US) 1985-05-14 US disclosed