SCHEMBL11082207

SCHEMBL11082207

CC1=C(C(=O)OCOC(=O)C(C)(C)C)N2C(=O)C(NC(=O)COc3ccccc3)[C@@H]2SC1

nearest known ligand 0.75

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ L3MBTL1 Q9Y468 3/20 0.59
▸ ALDH1A1 P00352 3/20 0.59
▸ PTGS1 P23219 1/20 0.54
▸ MAPK1 P28482 2/20 0.54
▸ PLCG1 P19174 1/20 0.53
▸ CTDSP1 Q9GZU7 2/20 0.53
▸ CACNA1B Q00975 2/20 0.46
▸ APBA1 Q02410 2/20 0.46
▸ KMT2A Q03164 2/20 0.45
▸ TDP1 Q9NUW8 2/20 0.45
▸ HSD17B10 Q99714 2/20 0.45
▸ BLM P54132 1/20 0.45
▸ CYP3A4 P08684 1/20 0.45
▸ CYP2C19 P33261 1/20 0.45
▸ MAPT P10636 1/20 0.45
▸ HPGD P15428 1/20 0.45
▸ ADRA1A P35348 1/20 0.45
▸ HTR2B P41595 1/20 0.45
▸ SLC15A2 Q16348 1/20 0.45

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
SCHEMBL11350424 1.00 L3MBTL1 (0.59) L3MBTL1ALDH1A1PTGS1MAPK1PLCG1
SCHEMBL11082205 1.00 L3MBTL1 (0.59) L3MBTL1ALDH1A1PTGS1MAPK1PLCG1
SCHEMBL11854386 0.90 L3MBTL1 (0.60) L3MBTL1ALDH1A1MAPK1PLCG1CTDSP1
SCHEMBL11854398 0.90 L3MBTL1 (0.60) L3MBTL1ALDH1A1MAPK1PLCG1CTDSP1
SCHEMBL10742739 0.89 L3MBTL1 (0.56) L3MBTL1ALDH1A1PTGS1MAPK1PLCG1
SCHEMBL10742744 0.89 L3MBTL1 (0.56) L3MBTL1ALDH1A1PTGS1MAPK1PLCG1
SCHEMBL17245015 0.89 L3MBTL1 (0.63) L3MBTL1ALDH1A1MAPK1PLCG1CTDSP1
SCHEMBL11581812 0.87 L3MBTL1 (0.59) L3MBTL1ALDH1A1MAPK1PLCG1CTDSP1
SCHEMBL11581809 0.87 L3MBTL1 (0.59) L3MBTL1ALDH1A1MAPK1PLCG1CTDSP1
SCHEMBL11582235 0.87 L3MBTL1 (0.59) L3MBTL1ALDH1A1MAPK1PLCG1CTDSP1

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0040494-B1 CARBAPENAMS AND CARBAPEN-2-EMS AND PROCESS THEREFOR PFIZER INC. (US) 1984-02-15 — — EP disclosed
US-4429128-A CARBAPENICILLINS, THIENAMYCINS, BACTERICIDES PFIZER INC. (US) 1984-01-31 — — US disclosed
US-4348264-A Photocatalyzed process for producing carbapenams and carbapen-2-ems PFIZER INC. (US) 1982-09-07 — — US disclosed
EP-0040494-A1 Carbapenams and carbapen-2-ems and process therefor PFIZER INC. (US) 1981-11-25 — — EP disclosed
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