SCHEMBL3974737

SCHEMBL3974737

N#Cc1c(O)ccc(C(=O)OC(=O)c2occc2-c2ccccc2OCCc2ccccc2)c1C(=O)NN

nearest known ligand 0.35

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.35
IDO1 P14902 2/20 0.32
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
SGMS2 Q8NHU3 1/20 0.32
MCL1 Q07820 1/20 0.31
CNR1 P21554 1/20 0.31
CNR2 P34972 1/20 0.31
S1PR1 P21453 1/20 0.30
S1PR3 Q99500 1/20 0.30
CYP19A1 P11511 1/20 0.30
CYP11B1 P15538 1/20 0.30
CYP11B2 P19099 1/20 0.30
BRD4 O60885 1/20 0.30

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
SCHEMBL3975349 0.92 MCL1 (0.40) ALDH1A1SGMS2MCL1
SCHEMBL3978765 0.90 UGCG (0.32) ALDH1A1MEN1KMT2ACNR2
SCHEMBL3975741 0.87 NR1H4 (0.38) ALDH1A1
SCHEMBL3977209 0.86 HSD17B10 (0.34) ALDH1A1MEN1KMT2ABRD4
SCHEMBL3974765 0.86 ALDH1A1 (0.36) ALDH1A1MEN1KMT2A
SCHEMBL3976979 0.85 IKBKB (0.34) ALDH1A1
SCHEMBL3985135 0.84 ALDH1A1 (0.32) ALDH1A1MEN1KMT2A
SCHEMBL3978191 0.84 ALDH1A1 (0.35) ALDH1A1MEN1KMT2A
SCHEMBL3976647 0.84 IDO1 (0.34) IDO1
SCHEMBL3978625 0.84 FAAH (0.36) CNR1CNR2

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 ALDH1A1 1389/4885IDO1 2854/4885MEN1 1481/4885

“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.