SCHEMBL9319235

SCHEMBL9319235

O=C(O)c1ccc2cc(O)c(O)cc2n1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MGAM O43451 1/20 0.55
▸ KDM4E B2RXH2 4/20 0.50
▸ KMT2A Q03164 2/20 0.50
▸ IGFBP3 P17936 5/20 0.45
▸ IGFBP5 P24593 4/20 0.45
▸ ALOX15 P16050 3/20 0.45
▸ TDP1 Q9NUW8 2/20 0.45
▸ TSHR P16473 2/20 0.45
▸ ACMSD Q8TDX5 1/20 0.45
▸ MEN1 O00255 1/20 0.42
▸ LMNA P02545 1/20 0.42
▸ MAPT P10636 1/20 0.41
▸ RAB9A P51151 1/20 0.41
▸ IGFBP1 P08833 1/20 0.41
▸ IGFBP2 P18065 1/20 0.41
▸ IGFBP4 P22692 1/20 0.41
▸ IGFBP6 P24592 1/20 0.41
▸ ALDH1A1 P00352 2/20 0.40
▸ HPGD P15428 1/20 0.40
▸ HSD17B10 Q99714 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
SCHEMBL12405037 0.87 MGAM (0.63) MGAMKDM4EKMT2AALOX15TDP1
SCHEMBL29411763 0.85 MGAM (0.49) MGAMKDM4EKMT2AIGFBP3IGFBP5
SCHEMBL26606765 0.85 MGAM (0.49) MGAMKDM4EKMT2AIGFBP3IGFBP5
SCHEMBL9220609 0.85 MGAM (0.61) MGAMKDM4EKMT2AALOX15TDP1
SCHEMBL950437 0.80 MGAM (0.60) MGAMKDM4EKMT2AALOX15TDP1
SCHEMBL20772073 0.78 MGAM (0.53) MGAMKDM4EKMT2AIGFBP5ALOX15
SCHEMBL2715968 0.78 MGAM (0.53) MGAMKDM4EKMT2AIGFBP5ALOX15
SCHEMBL2211860 0.78 MGAM (0.58) MGAMKDM4EKMT2AALOX15TDP1
SCHEMBL12501532 0.78 MGAM (0.69) MGAMKDM4EKMT2AALOX15TDP1
SCHEMBL28278979 0.76 MGAM (0.60) MGAMKDM4EKMT2AALOX15TDP1

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
US-5371220-A Bicyclo-heterocyclic intermediates for cephalosporin compounds IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1994-12-06 — — US disclosed
US-5232918-A Bactericides IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1993-08-03 — — US disclosed
US-5019570-A Antibioics IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1991-05-28 — — US disclosed
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