SCHEMBL9312656

SCHEMBL9312656

ON=C(Cc1ccc(O)c(O)c1)NO

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 5/20 0.48
▸ KDM4E B2RXH2 5/20 0.48
▸ THPO P40225 4/20 0.48
▸ HIF1A Q16665 4/20 0.48
▸ HSD17B10 Q99714 4/20 0.48
▸ NFKB1 P19838 3/20 0.48
▸ LMNA P02545 3/20 0.48
▸ HPGD P15428 3/20 0.48
▸ BLM P54132 3/20 0.48
▸ PMP22 Q01453 3/20 0.48
▸ GAA P10253 2/20 0.48
▸ TSHR P16473 2/20 0.48
▸ APEX1 P27695 2/20 0.48
▸ TDP1 Q9NUW8 2/20 0.48
▸ POLB P06746 2/20 0.48
▸ RGS12 O14924 1/20 0.48
▸ GNAI1 P63096 1/20 0.48
▸ CA1 P00915 1/20 0.47
▸ CA2 P00918 1/20 0.47
▸ CA4 P22748 1/20 0.47

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
SCHEMBL9313613 0.81 SELP (0.35) MAPTKDM4ELMNABLMGAA
SCHEMBL9313520 0.75 HSP90AB1 (0.42) BACE1CYP3A4PTGS2
SCHEMBL9313486 0.73 KDM4E (0.62) MAPTKDM4ETHPOHIF1AHSD17B10
SCHEMBL9313028 0.73 KDM4E (0.52) MAPTKDM4ETHPOHIF1AHSD17B10
SCHEMBL9312627 0.73 MEN1 (0.38) MAPTKDM4ETHPOHIF1AHSD17B10
SCHEMBL9576947 0.72 HDAC8 (0.52) LMNAGAACA1CA2ALDH1A1
SCHEMBL9312668 0.72 ESR1 (0.33) KDM4ETHPOHSD17B10ALDH1A1MTOR
SCHEMBL28351250 0.70 TRPA1 (0.53) MAPTKDM4ETHPOHIF1AHSD17B10
SCHEMBL9312639 0.68 PTPN1 (0.36) MAPTAPEX1TDP1CA1CA2
SCHEMBL22982989 0.67 KDM4E (0.72) MAPTKDM4ETHPOHIF1AHSD17B10

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-5366996-A Administering hydroxamic acids ELFORD HOWARD L (US) 1994-11-22 — — US disclosed
US-5183828-A Ribonucleotide reductase inhibitor and free radical scavenger RIET BARTHOLOMEUS VAN T (US) 1993-02-02 — — US disclosed
US-4942253-A INHIBITORS OF RIBONUCLEOTIDE REDUCTASE, ANTITUMOR AGENTS, LEUKEMIA, FREE RADICAL SCAVENGERS RIET BARTHOLOMEUS VAN T (US) 1990-07-17 — — US disclosed
US-4623659-A RIBONUCLEOTIDE REDUCTASE INHIBITORS RIET BARTHOLOMEUS VAN T (US) 1986-11-18 — — US disclosed
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