SCHEMBL9313101

SCHEMBL9313101

N=C(N)Cc1ccc(O)cc1O

nearest known ligand 0.56

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ TYR P14679 6/20 0.56
▸ MEN1 O00255 3/20 0.46
▸ KMT2A Q03164 3/20 0.46
▸ ALOX5 P09917 3/20 0.46
▸ MAPT P10636 2/20 0.43
▸ TP53 P04637 1/20 0.43
▸ CYP3A4 P08684 1/20 0.43
▸ ALOX15 P16050 1/20 0.43
▸ TSHR P16473 1/20 0.43
▸ HTT P42858 1/20 0.43
▸ TDP1 Q9NUW8 1/20 0.43

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
SCHEMBL9312477 0.83 EGFR (0.44) TYRMAPTTP53CYP3A4ALOX15
SCHEMBL28875498 0.79 MEN1 (0.58) TYRMEN1KMT2AALOX5
SCHEMBL9313064 0.76 TYR (0.52) TYRMEN1KMT2AALOX5MAPT
SCHEMBL9313910 0.76 MEN1 (0.48) MEN1KMT2AMAPTCYP3A4ALOX15
SCHEMBL9313957 0.75 MEN1 (0.34) TYRMEN1KMT2AMAPTTDP1
SCHEMBL29419312 0.74 TYR (0.60) TYRMEN1KMT2AALOX5TSHR
SCHEMBL9313934 0.74 ESR2 (0.37) MEN1KMT2AMAPTCYP3A4TDP1
SCHEMBL3022818 0.74 TYR (0.60) TYRMEN1KMT2AALOX5MAPT
SCHEMBL156238 0.74 TYR (0.60) TYRMEN1KMT2AALOX5TSHR
SCHEMBL28718751 0.74 TYR (0.60) TYRMEN1KMT2AALOX5

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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