SCHEMBL9638907

SCHEMBL9638907

CC(C)(C)SC1CC(=O)N1CC(=O)O

nearest known ligand 0.35

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.35
RIPK1 Q13546 2/20 0.33
POLB P06746 1/20 0.33
SIGMAR1 Q99720 1/20 0.33
TSHR P16473 2/20 0.33
ACE P12821 2/20 0.31
MEN1 O00255 1/20 0.30
GSK3A P49840 1/20 0.30
GSK3B P49841 1/20 0.30
KMT2A Q03164 1/20 0.30
APEX1 P27695 1/20 0.30
BLM P54132 1/20 0.30
ALDH1A1 P00352 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
SCHEMBL8094793 0.81 L3MBTL1 (0.37) L3MBTL1POLBSIGMAR1TSHRACE
SCHEMBL10583522 0.79 L3MBTL1 (0.31) L3MBTL1
SCHEMBL11454413 0.76 ALDH1A1 (0.38) L3MBTL1SIGMAR1TSHRMEN1GSK3A
SCHEMBL8439418 0.72 SIGMAR1 (0.40) L3MBTL1POLBSIGMAR1TSHRKMT2A
SCHEMBL11460980 0.72 L3MBTL1 (0.49) L3MBTL1POLBTSHRMEN1KMT2A
SCHEMBL8441054 0.69 PDPK1 (0.49) KMT2AALDH1A1
SCHEMBL8442219 0.69 CYP2C19 (0.40) L3MBTL1POLBSIGMAR1TSHRACE
SCHEMBL8374671 0.69 CYP2C19 (0.40) L3MBTL1POLBSIGMAR1TSHRACE
SCHEMBL8438654 0.69 CYP2C19 (0.40) L3MBTL1POLBSIGMAR1TSHRACE
SCHEMBL8443663 0.66 ALDH1A1 (0.46) L3MBTL1TSHRMEN1KMT2AALDH1A1

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
US-5108747-A STABLE OXPENEM-3-CARBOXYLIC ACIDS AS BETA-LACTAMASE INHIBITORS BAYER AKTIENGESELLSCHAFT (DE) 1992-04-28 US disclosed
US-5096899-A Nonhydrolyzing oxapenicillins BAYER AKTIENGESELLSCHAFT (DE) 1992-03-17 US disclosed