SCHEMBL11281492

SCHEMBL11281492

CCc1ccc(OCC[C]=O)cc1

nearest known ligand 0.54

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 4/20 0.54
▸ MAPT P10636 2/20 0.54
▸ ALDH1A1 P00352 1/20 0.54
▸ HPGD P15428 1/20 0.54
▸ SMN1; SMN2 Q16637 1/20 0.54
▸ SOD1 P00441 1/20 0.46
▸ RXRA P19793 1/20 0.45
▸ RXRB P28702 1/20 0.45
▸ KDM4E B2RXH2 1/20 0.44
▸ HRH3 Q9Y5N1 1/20 0.44
▸ L3MBTL1 Q9Y468 2/20 0.42
▸ CISD1 Q9NZ45 1/20 0.42
▸ KMT2A Q03164 2/20 0.41
▸ NPC1 O15118 1/20 0.41
▸ RAB9A P51151 1/20 0.41
▸ HTT P42858 2/20 0.41
▸ MEN1 O00255 1/20 0.41

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
SCHEMBL5254423 0.91 LMNA (0.57) LMNAMAPTALDH1A1HPGDSMN1; SMN2
SCHEMBL7352169 0.84 NQO1 (0.58) LMNAMAPTALDH1A1SMN1; SMN2KDM4E
SCHEMBL5254163 0.81 LMNA (0.56) LMNAALDH1A1SMN1; SMN2KDM4EL3MBTL1
SCHEMBL5929490 0.81 MAPT (0.62) LMNAMAPTALDH1A1HPGDSMN1; SMN2
SCHEMBL8277612 0.81 GAA (0.54) LMNAMAPTALDH1A1HPGDSMN1; SMN2
SCHEMBL5258291 0.81 NR5A1 (0.56) NPC1RAB9A
SCHEMBL15873588 0.81 HRH3 (0.46) LMNAALDH1A1SMN1; SMN2KDM4EHRH3
SCHEMBL21052116 0.80 L3MBTL1 (0.53) ALDH1A1HPGDL3MBTL1KMT2ANPC1
SCHEMBL17445912 0.79 ALDH1A1 (0.66) LMNAMAPTALDH1A1HPGDSMN1; SMN2
SCHEMBL909956 0.78 LMNA (0.58) LMNAMAPTALDH1A1SMN1; SMN2L3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4336191-A Penicillin conversion by halogen electrophiles and anti-bacterials derived thereby ELI LILLY AND COMPANY (US) 1982-06-22 — — US disclosed
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