SCHEMBL11222254

SCHEMBL11222254

CC(=O)OC=C1S[C@H]2C(NC(=O)COc3ccccc3)C(=O)N2C(C(=O)O)=C1C

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ L3MBTL1 Q9Y468 4/20 0.51
▸ CTDSP1 Q9GZU7 2/20 0.49
▸ TDP1 Q9NUW8 3/20 0.45
▸ MAPK1 P28482 1/20 0.43
▸ MAPT P10636 2/20 0.41
▸ ALDH1A1 P00352 1/20 0.41
▸ LMNA P02545 1/20 0.41
▸ CYP1A2 P05177 1/20 0.41
▸ CYP2D6 P10635 1/20 0.41
▸ CYP2C19 P33261 1/20 0.41
▸ NR1I2 O75469 1/20 0.41
▸ HPGD P15428 1/20 0.41
▸ DNMT1 P26358 1/20 0.41
▸ SLC22A6 Q4U2R8 1/20 0.41
▸ SLC22A8 Q8TCC7 1/20 0.41
▸ SLC22A11 Q9NSA0 1/20 0.41
▸ POLB P06746 1/20 0.40
▸ PKM P14618 1/20 0.40
▸ HTT P42858 1/20 0.40
▸ DUSP3 P51452 1/20 0.40

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
SCHEMBL11222250 1.00 L3MBTL1 (0.51) L3MBTL1CTDSP1TDP1MAPK1MAPT
SCHEMBL11222480 0.91 CTDSP1 (0.48) L3MBTL1CTDSP1TDP1MAPK1MAPT
SCHEMBL11222477 0.91 CTDSP1 (0.48) L3MBTL1CTDSP1TDP1MAPK1MAPT
SCHEMBL11232477 0.90 CTDSP1 (0.49) L3MBTL1CTDSP1TDP1MAPK1MAPT
SCHEMBL11232482 0.90 CTDSP1 (0.49) L3MBTL1CTDSP1TDP1MAPK1MAPT
SCHEMBL11218235 0.88 L3MBTL1 (0.51) L3MBTL1CTDSP1TDP1MAPK1MAPT
SCHEMBL11218232 0.88 L3MBTL1 (0.51) L3MBTL1CTDSP1TDP1MAPK1MAPT
SCHEMBL11078737 0.85 CTDSP1 (0.58) L3MBTL1CTDSP1TDP1MAPK1MAPT
SCHEMBL11226408 0.84 PLCG1 (0.55) L3MBTL1CTDSP1TDP1ALDH1A1LMNA
SCHEMBL11226411 0.84 PLCG1 (0.55) L3MBTL1CTDSP1TDP1ALDH1A1LMNA

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
US-4299954-A MICROBIOCIDES ELI LILLY AND COMPANY (US) 1981-11-10 — — US claimed
US-4334064-A Cephalosporin vinyl halides ELI LILLY AND COMPANY (US) 1982-06-08 — — US disclosed
US-4334063-A Cephalosporin vinyl halides ELI LILLY AND COMPANY (US) 1982-06-08 — — US disclosed
US-4299954-A MICROBIOCIDES ELI LILLY AND COMPANY (US) 1981-11-10 — — US disclosed
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