SCHEMBL17219080

SCHEMBL17219080

COc1cccc([C]=NOCc2cccc(OC)c2)c1

nearest known ligand 0.53

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ IDO1 P14902 2/20 0.53
▸ AGXT P21549 2/20 0.53
▸ MAOB P27338 7/20 0.50
▸ CHRM2 P08172 1/20 0.46
▸ CHRM1 P11229 1/20 0.46
▸ CHRM3 P20309 1/20 0.46
▸ TAAR1 Q96RJ0 3/20 0.45
▸ ABCB1 P08183 1/20 0.43
▸ HTR1A P08908 1/20 0.43
▸ DRD2 P14416 1/20 0.43
▸ CMA1 P23946 1/20 0.42

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
SCHEMBL17219078 1.00 IDO1 (0.53) IDO1AGXTMAOBCHRM2CHRM1
SCHEMBL17217352 0.93 MAOB (0.54) IDO1AGXTMAOBCHRM2CHRM1
SCHEMBL17217355 0.93 MAOB (0.54) IDO1AGXTMAOBCHRM2CHRM1
SCHEMBL17215827 0.93 IDO1 (0.51) IDO1AGXTMAOBCHRM2CHRM1
SCHEMBL17215826 0.93 IDO1 (0.51) IDO1AGXTMAOBCHRM2CHRM1
SCHEMBL17216675 0.92 IDO1 (0.44) IDO1AGXTMAOB
SCHEMBL17215998 0.92 MAOB (0.54) IDO1AGXTMAOBCHRM2CHRM1
SCHEMBL17217511 0.92 MAOB (0.57) IDO1AGXTMAOB
SCHEMBL17217513 0.92 MAOB (0.57) IDO1AGXTMAOB
SCHEMBL17217228 0.92 IDO1 (0.48) IDO1AGXTMAOBCHRM2CHRM1

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 IDO1 2882/4885AGXT 1423/4885MAOB 3611/4885

“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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