SCHEMBL3982901

SCHEMBL3982901

COc1ccc(C(=O)OC(=O)c2occ(-c3ccccc3)c2-c2ccccc2)c(C(=O)NN)c1NS(C)(=O)=O

nearest known ligand 0.43

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
TP53 P04637 1/20 0.33
POLB P06746 1/20 0.33
CTSD P07339 1/20 0.33
ACLY P53396 4/20 0.33
RXFP1 Q9HBX9 1/20 0.33
ALDH1A1 P00352 3/20 0.32
MEN1 O00255 2/20 0.32
KMT2A Q03164 2/20 0.32
KDM4E B2RXH2 1/20 0.32
HPGD P15428 1/20 0.32
MAPK1 P28482 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
LMNA P02545 1/20 0.31

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
SCHEMBL3976620 0.90 MCL1 (0.33) POLBMAPK1SMN1; SMN2
SCHEMBL3974632 0.87 CTSD (0.38) TP53POLBCTSDRXFP1ALDH1A1
SCHEMBL3976794 0.86 TP53 (0.33) TP53POLBCTSDACLYRXFP1
SCHEMBL3978027 0.86 CTSD (0.37) TP53POLBCTSDACLYRXFP1
SCHEMBL3974207 0.86 ACLY (0.37) TP53POLBCTSDACLYALDH1A1
SCHEMBL3978639 0.86 HTT (0.37) TP53POLBCTSDRXFP1ALDH1A1
SCHEMBL3982340 0.85 CTSD (0.36) TP53POLBCTSDACLYRXFP1
SCHEMBL3977002 0.85 POLB (0.37) TP53POLBCTSDRXFP1ALDH1A1
SCHEMBL3976151 0.84 MTNR1A (0.33) TP53POLBCTSDRXFP1ALDH1A1
SCHEMBL3978783 0.82 S1PR1 (0.35) TP53POLBCTSDACLYRXFP1

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-7514452-B2 2-furancarboxylic acid hydrazides and pharmaceutical compositions containing the same DAINIPPON PHARMACEUTICAL CO., LTD (JP) 2009-04-07 US disclosed
US-20050171196-A1 2-Furancarboxylic acid hydrazides and pharmaceutical compositions containing the same DAINIPPON SUMITOMO PHARMA CO., LTD. (JP) 2005-08-04 US disclosed
EP-1489077-A1 2-FURANCARBOXYLIC ACID HYDRAZIDES AND PHARMACEUTICAL COMPOSITIONS CONTAINING THE SAME DAINIPPON PHARMACEUTICAL CO., LTD. (JP) 2004-12-22 EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20050171196-A1 2-Furancarboxylic acid hydrazides and pharmaceutical compositions containing the same GLP1R, GCGR, GPR119 TP53 2395/4885POLB 4676/4885CTSD 2014/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.