SCHEMBL9830174

SCHEMBL9830174

CC[C@H](C)[C@](O)(NC(=O)c1cc2ccccc2cc1O)C(=O)O

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 9/20 0.50
▸ MEN1 O00255 8/20 0.50
▸ MAPT P10636 4/20 0.50
▸ TDP1 Q9NUW8 3/20 0.50
▸ GAA P10253 2/20 0.50
▸ MITF O75030 1/20 0.50
▸ NCOA1 Q15788 1/20 0.50
▸ NCOA3 Q9Y6Q9 1/20 0.50
▸ KDM4E B2RXH2 2/20 0.46
▸ ALDH1A1 P00352 2/20 0.46
▸ CASP1 P29466 1/20 0.46
▸ CASP7 P55210 1/20 0.46
▸ HTT P42858 1/20 0.46
▸ SMN1; SMN2 Q16637 1/20 0.46
▸ POLB P06746 5/20 0.45
▸ NPC1 O15118 5/20 0.45
▸ RAB9A P51151 5/20 0.45
▸ MAPK1 P28482 1/20 0.45
▸ APOBEC3A P31941 1/20 0.45
▸ APOBEC3G Q9HC16 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
SCHEMBL9830170 1.00 KMT2A (0.50) KMT2AMEN1MAPTTDP1GAA
SCHEMBL9828729 0.78 ALDH1A1 (0.48) KMT2AGAAALDH1A1SMN1; SMN2POLB
SCHEMBL9828728 0.78 ALDH1A1 (0.48) KMT2AGAAALDH1A1SMN1; SMN2POLB
SCHEMBL2743109 0.73 KMT2A (0.62) KMT2AMEN1MAPTTDP1GAA
SCHEMBL9830870 0.70 POLB (0.49) KMT2AMEN1KDM4EALDH1A1POLB
SCHEMBL9830875 0.70 POLB (0.49) KMT2AMEN1KDM4EALDH1A1POLB
SCHEMBL11154417 0.70 KMT2A (0.62) KMT2AMEN1MAPTTDP1GAA
SCHEMBL11310218 0.70 MEN1 (0.62) KMT2AMEN1MAPTTDP1GAA
SCHEMBL9313734 0.70 MAPT (0.69) KMT2AMEN1MAPTTDP1GAA
SCHEMBL5143499 0.69 KMT2A (0.60) KMT2AMEN1MAPTTDP1GAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0226304-B1 COMPOSITION CONTAINING A PENEM OR CARBAPENEM ANTIBIOTIC SANKYO COMPANY LIMITED (JP) 1991-08-28 — — EP disclosed
US-4757066-A Reduces renal toxicity SANKYO COMPANY LIMITED (JP) 1988-07-12 — — US disclosed
EP-0226304-A1 Composition containing a penem or carbapenem antibiotic SANKYO COMPANY LIMITED (JP) 1987-06-24 — — EP disclosed
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