SCHEMBL17217352

SCHEMBL17217352

COc1cccc(/[C]=N\OCc2ccccc2)c1

nearest known ligand 0.54

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ MAOB P27338 4/20 0.54
▸ IDO1 P14902 2/20 0.44
▸ AGXT P21549 2/20 0.44
▸ ABCB1 P08183 2/20 0.44
▸ HTR1A P08908 1/20 0.44
▸ DRD2 P14416 1/20 0.44
▸ BCHE P06276 2/20 0.43
▸ SIGMAR1 Q99720 1/20 0.42
▸ FFAR1 O14842 1/20 0.42
▸ CHRM2 P08172 1/20 0.42
▸ CHRM1 P11229 1/20 0.42
▸ CHRM3 P20309 1/20 0.42
▸ CA4 P22748 1/20 0.41
▸ LTA4H P09960 1/20 0.41
▸ G6PC1 P35575 1/20 0.41
▸ TAAR1 Q96RJ0 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
SCHEMBL17217355 1.00 MAOB (0.54) MAOBIDO1AGXTABCB1HTR1A
SCHEMBL17218037 0.93 MAOB (0.47) MAOBIDO1AGXTABCB1BCHE
SCHEMBL17218035 0.93 MAOB (0.47) MAOBIDO1AGXTABCB1BCHE
SCHEMBL17219078 0.93 IDO1 (0.53) MAOBIDO1AGXTABCB1HTR1A
SCHEMBL17219080 0.93 IDO1 (0.53) MAOBIDO1AGXTABCB1HTR1A
SCHEMBL17216890 0.92 MAOB (0.46) MAOBABCB1BCHEFFAR1
SCHEMBL17216887 0.92 MAOB (0.46) MAOBABCB1BCHEFFAR1
SCHEMBL17215826 0.91 IDO1 (0.51) MAOBIDO1AGXTABCB1HTR1A
SCHEMBL17215827 0.91 IDO1 (0.51) MAOBIDO1AGXTABCB1HTR1A
SCHEMBL17218712 0.91 MAOB (0.44) MAOBIDO1AGXTHTR1ASIGMAR1

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

“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.

Send feedback