SCHEMBL3976676

SCHEMBL3976676

CC(C)(C)C(=O)Oc1ccc(C(=O)NNC(=O)c2occ(-c3ccccc3)c2-c2ccccc2)cc1C#N

nearest known ligand 0.57

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ELANE P08246 6/20 0.40
ALDH1A1 P00352 3/20 0.40
KDM4E B2RXH2 2/20 0.40
MAPT P10636 2/20 0.40
HPGD P15428 2/20 0.40
KMT2A Q03164 2/20 0.40
MEN1 O00255 1/20 0.40
HTT P42858 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
HSD17B10 Q99714 1/20 0.40
GRM5 P41594 1/20 0.38
LMNA P02545 2/20 0.36
SLC22A12 Q96S37 1/20 0.35

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
SCHEMBL3973495 0.90 MAOB (0.43) ALDH1A1KDM4EMAPTHPGDKMT2A
SCHEMBL3982962 0.88 KDM4E (0.39) ALDH1A1KDM4EMAPTHPGDKMT2A
SCHEMBL3979538 0.88 ALDH1A1 (0.49) ALDH1A1KDM4EMAPTHPGDKMT2A
SCHEMBL3977139 0.84 ALDH1A1 (0.43) ALDH1A1KDM4EMAPTHPGDKMT2A
SCHEMBL3975924 0.81 GRM5 (0.41) KDM4EKMT2AMEN1GRM5LMNA
SCHEMBL3979482 0.78 KMT2A (0.46) ALDH1A1KDM4EMAPTHPGDKMT2A
SCHEMBL3978634 0.77 CYP3A4 (0.56) ALDH1A1KDM4EMAPTHPGDKMT2A
SCHEMBL3974631 0.77 CTSA (0.47) ALDH1A1KDM4EMAPTHPGDKMT2A
SCHEMBL3977598 0.76 GRM5 (0.40) GRM5SLC22A12
SCHEMBL3978024 0.74 CYP3A4 (0.45) ALDH1A1KDM4EMAPTHPGDKMT2A

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 ELANE 1531/4885ALDH1A1 1389/4885KDM4E 2769/4885

“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.