SCHEMBL11078737

SCHEMBL11078737

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

nearest known ligand 0.65

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ CTDSP1 Q9GZU7 1/20 0.58
▸ L3MBTL1 Q9Y468 2/20 0.52
▸ MAPK1 P28482 1/20 0.50
▸ ALDH1A1 P00352 1/20 0.46
▸ LMNA P02545 1/20 0.46
▸ CYP1A2 P05177 1/20 0.46
▸ CYP2D6 P10635 1/20 0.46
▸ CYP2C19 P33261 1/20 0.46
▸ TDP1 Q9NUW8 2/20 0.45
▸ POLB P06746 1/20 0.43
▸ MAPT P10636 1/20 0.43
▸ PKM P14618 1/20 0.43
▸ HTT P42858 1/20 0.43
▸ DUSP3 P51452 1/20 0.43
▸ PTPN5 P54829 1/20 0.43
▸ PTPN11 Q06124 1/20 0.43
▸ SPOP O43791 1/20 0.42

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
SCHEMBL11265118 0.90 CTDSP1 (0.56) CTDSP1L3MBTL1MAPK1ALDH1A1LMNA
SCHEMBL11265123 0.90 CTDSP1 (0.56) CTDSP1L3MBTL1MAPK1ALDH1A1LMNA
SCHEMBL11080378 0.86 CTDSP1 (0.48) CTDSP1L3MBTL1MAPK1ALDH1A1LMNA
SCHEMBL10959551 0.85 L3MBTL1 (0.58) CTDSP1L3MBTL1MAPK1ALDH1A1LMNA
SCHEMBL11222254 0.85 L3MBTL1 (0.51) CTDSP1L3MBTL1MAPK1ALDH1A1LMNA
SCHEMBL11222250 0.85 L3MBTL1 (0.51) CTDSP1L3MBTL1MAPK1ALDH1A1LMNA
SCHEMBL11222477 0.84 CTDSP1 (0.48) CTDSP1L3MBTL1MAPK1ALDH1A1LMNA
SCHEMBL11222480 0.84 CTDSP1 (0.48) CTDSP1L3MBTL1MAPK1ALDH1A1LMNA
SCHEMBL11075261 0.84 CTDSP1 (0.46) CTDSP1L3MBTL1MAPK1ALDH1A1LMNA
SCHEMBL11254346 0.84 CTDSP1 (0.51) CTDSP1L3MBTL1MAPK1ALDH1A1LMNA

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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