SCHEMBL17218192

SCHEMBL17218192

Brc1cccc(/[C]=N\OCc2cccc(-c3ccccc3)c2)c1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ AGXT P21549 4/20 0.45
▸ NAAA Q02083 2/20 0.40
▸ MAOB P27338 2/20 0.40
▸ FFAR1 O14842 5/20 0.40
▸ GABRG2 P18507 2/20 0.40
▸ GABRB3 P28472 2/20 0.40
▸ GABRA5 P31644 2/20 0.40
▸ GABRA3 P34903 2/20 0.40
▸ IDO1 P14902 2/20 0.40
▸ FFAR4 Q5NUL3 2/20 0.38
▸ AKR1B1 P15121 1/20 0.38
▸ CYP3A4 P08684 1/20 0.37
▸ CYP2C9 P11712 1/20 0.37
▸ TSHR P16473 1/20 0.37
▸ CYP2C19 P33261 1/20 0.37
▸ NR4A2 P43354 1/20 0.36
▸ HCAR2 Q8TDS4 1/20 0.35
▸ MMP1 P03956 1/20 0.34
▸ MMP2 P08253 1/20 0.34
▸ MMP12 P39900 1/20 0.34

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
SCHEMBL17218195 1.00 AGXT (0.45) AGXTNAAAMAOBFFAR1GABRG2
SCHEMBL17217882 0.90 MAOB (0.41) AGXTNAAAMAOBGABRG2GABRB3
SCHEMBL17217885 0.90 MAOB (0.41) AGXTNAAAMAOBGABRG2GABRB3
SCHEMBL17217972 0.90 MAOB (0.49) AGXTMAOBFFAR1GABRG2GABRB3
SCHEMBL17217973 0.90 MAOB (0.49) AGXTMAOBFFAR1GABRG2GABRB3
SCHEMBL17216425 0.89 AGXT (0.53) AGXTNAAAFFAR1GABRG2GABRB3
SCHEMBL17216423 0.89 AGXT (0.53) AGXTNAAAFFAR1GABRG2GABRB3
SCHEMBL17217396 0.88 AGXT (0.46) AGXTNAAAMAOBFFAR1GABRG2
SCHEMBL17217394 0.88 AGXT (0.46) AGXTNAAAMAOBFFAR1GABRG2
SCHEMBL17218182 0.84 AGXT (0.45) AGXTNAAAFFAR1FFAR4AKR1B1

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 AGXT 1423/4885NAAA 3413/4885MAOB 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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