SCHEMBL3976847

SCHEMBL3976847

CCOC(=O)c1occc1-c1cccc(N)c1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SMN1; SMN2 Q16637 5/20 0.53
▸ ALDH1A1 P00352 7/20 0.52
▸ MAPT P10636 7/20 0.52
▸ KDM4E B2RXH2 4/20 0.52
▸ L3MBTL1 Q9Y468 1/20 0.52
▸ CSNK1D P48730 1/20 0.43
▸ HSD17B10 Q99714 5/20 0.43
▸ RAB9A P51151 5/20 0.43
▸ NPC1 O15118 4/20 0.43
▸ MEN1 O00255 3/20 0.43
▸ KMT2A Q03164 3/20 0.43
▸ ALOX15 P16050 3/20 0.43
▸ HPGD P15428 2/20 0.43
▸ GAA P10253 2/20 0.43
▸ AHR P35869 1/20 0.42
▸ LMNA P02545 2/20 0.41
▸ CYP1A2 P05177 1/20 0.41
▸ CYP3A4 P08684 1/20 0.41
▸ MAOA P21397 1/20 0.41
▸ MAPK1 P28482 1/20 0.41

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
SCHEMBL3979529 0.86 JAK2 (0.44) SMN1; SMN2ALDH1A1MAPTKDM4EL3MBTL1
SCHEMBL3977097 0.85 FNTA (0.46) ALDH1A1MAPTKDM4ECSNK1DHSD17B10
SCHEMBL106734 0.83 PRKCZ (0.53) SMN1; SMN2ALDH1A1MAPTKDM4EHSD17B10
SCHEMBL3982536 0.83 TSHR (0.47) SMN1; SMN2ALDH1A1MAPTKDM4EHSD17B10
SCHEMBL3977084 0.81 ALDH1A1 (0.52) SMN1; SMN2ALDH1A1MAPTKDM4EL3MBTL1
SCHEMBL3976513 0.80 KDM4E (0.47) SMN1; SMN2ALDH1A1KDM4EHSD17B10RAB9A
SCHEMBL3978291 0.79 HPGD (0.39) SMN1; SMN2ALDH1A1MAPTKDM4EL3MBTL1
SCHEMBL7732476 0.79 SMN1; SMN2 (0.53) SMN1; SMN2ALDH1A1MAPTKDM4EL3MBTL1
SCHEMBL3981898 0.79 PTGER4 (0.42) SMN1; SMN2ALDH1A1MAPTKDM4EL3MBTL1
Hydrochloric Acid SCHEMBL2895852 0.78 SMN1; SMN2 (0.52) SMN1; SMN2ALDH1A1MAPTKDM4EL3MBTL1

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101730703-A Benzamide derivatives with antiproliferative activity and pharmaceutical preparations thereof RADIATION MEDICINE OF PLA MILI 2010-06-09 — — CN disclosed
CN-100543022-C 2-furancarboxylic acid hydrazide compound and contain the pharmaceutical composition of this compound DAINIPPON PHARMACEUTICAL CO (JP) 2009-09-23 — — CN disclosed
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
CN-1628111-A 2-furancarboxylic acid hydrazides and pharmaceutical compositions containing the same DAINIPPON PHARMACEUTICAL CO (JP) 2005-06-15 — — CN 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 SMN1; SMN2 3697/4885ALDH1A1 1389/4885MAPT 4833/4885

“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.

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