SCHEMBL17216604

SCHEMBL17216604

CO/N=C(\C)c1ccc(O)c([N+](=O)[O-])c1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 4/20 0.48
ALDH1A1 P00352 4/20 0.48
MAPK1 P28482 2/20 0.47
HPGD P15428 2/20 0.47
GPR35 Q9HC97 2/20 0.47
TP53 P04637 1/20 0.47
TSHR P16473 1/20 0.47
L3MBTL1 Q9Y468 2/20 0.46
ALOX15 P16050 1/20 0.46
HSD17B10 Q99714 1/20 0.46
ALDH5A1 P51649 1/20 0.44
ABAT P80404 1/20 0.44
CA12 O43570 1/20 0.44
CA1 P00915 1/20 0.44
CA2 P00918 1/20 0.44
CA9 Q16790 1/20 0.44
DPP4 P27487 1/20 0.44
PREP P48147 1/20 0.44
DPP9 Q86TI2 1/20 0.44
MAPT P10636 4/20 0.43

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
SCHEMBL15851127 1.00 SMN1; SMN2 (0.48) SMN1; SMN2ALDH1A1MAPK1HPGDGPR35
SCHEMBL9658211 0.81 TPMT (0.46) SMN1; SMN2ALDH1A1MAPK1HPGDGPR35
SCHEMBL9658209 0.81 TPMT (0.46) SMN1; SMN2ALDH1A1MAPK1HPGDGPR35
SCHEMBL9659596 0.80 DPP4 (0.43) SMN1; SMN2ALDH1A1MAPK1HPGDGPR35
SCHEMBL9659586 0.80 DPP4 (0.43) SMN1; SMN2ALDH1A1MAPK1HPGDGPR35
SCHEMBL532487 0.77 MAPK1 (0.56) SMN1; SMN2ALDH1A1MAPK1HPGDGPR35
SCHEMBL30527129 0.77 MAPK1 (0.56) SMN1; SMN2ALDH1A1MAPK1HPGDGPR35
SCHEMBL531728 0.76 VCAM1 (0.64) SMN1; SMN2ALDH1A1MAPK1HPGDGPR35
SCHEMBL12857714 0.76 MAPK1 (0.55) SMN1; SMN2ALDH1A1MAPK1HPGDGPR35
SCHEMBL10022020 0.76 MAPK1 (0.56) SMN1; SMN2ALDH1A1MAPK1TSHRL3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2940012-B1 TETRAZOLINONE COMPOUND AND APPLICATIONS THEREOF SUMITOMO CHEMICAL CO (JP) 2019-01-30 EP disclosed
US-9560850-B2 Tetrazolinone compound and use thereof SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2017-02-07 US disclosed
US-20150336908-A1 TETRAZOLINONE COMPOUND AND USE THEREOF SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2015-11-26 US disclosed
EP-2940012-A1 TETRAZOLINONE COMPOUND AND APPLICATIONS THEREOF Sumitomo Chemical Company Limited (JP) 2015-11-04 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-20150336908-A1 TETRAZOLINONE COMPOUND AND USE THEREOF RTN3, CYP51A1, TCOF1 SMN1; SMN2 4013/4885ALDH1A1 2300/4885MAPK1 1283/4885

“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.