SCHEMBL3979343

SCHEMBL3979343

Cc1ccccc1COc1cccc(-c2ccoc2C(=O)OC(=O)c2ccc(O)c(C#N)c2C(=O)NN)c1

nearest known ligand 0.36

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
SPHK2 Q9NRA0 2/20 0.36
SPHK1 Q9NYA1 2/20 0.36
MCL1 Q07820 1/20 0.34
CD274 Q9NZQ7 4/20 0.34
KDM4E B2RXH2 1/20 0.33
PTGER4 P35408 2/20 0.33
ESR1 P03372 1/20 0.33
TP53 P04637 1/20 0.33
POLB P06746 1/20 0.33
APEX1 P27695 1/20 0.33
MAPK1 P28482 1/20 0.33
ESR2 Q92731 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
SLC26A4 O43511 1/20 0.32
PTGER1 P34995 1/20 0.32
PTGER3 P43115 1/20 0.32
PTGER2 P43116 1/20 0.32

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
SCHEMBL3976994 0.90 ALOX15 (0.31) ESR1TP53POLBAPEX1MAPK1
SCHEMBL3977732 0.90 GUSB (0.39) KDM4EMAPK1
SCHEMBL3976427 0.87 USP2 (0.38) MCL1KDM4EMAPK1
SCHEMBL3977571 0.87 SPHK2 (0.36) SPHK2SPHK1MCL1PTGER4ESR1
SCHEMBL3973253 0.86 MEN1 (0.36) KDM4E
SCHEMBL3976065 0.86 GPR132 (0.37) CD274MAPK1
SCHEMBL3975741 0.86 NR1H4 (0.38) KDM4EMAPK1
SCHEMBL3976483 0.85 MAPK8 (0.39) MCL1MAPK1
SCHEMBL3976175 0.84 FABP1 (0.31)
SCHEMBL3974765 0.84 ALDH1A1 (0.36) CD274KDM4EESR1POLBMAPK1

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 SPHK2 2627/4885SPHK1 2832/4885MCL1 2480/4885

“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.