SCHEMBL17215904

SCHEMBL17215904

N#Cc1cccc(/[C]=N\OCc2cc(F)cc(F)c2)c1

nearest known ligand 0.36

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ IDO1 P14902 2/20 0.35
▸ ENPP2 Q13822 1/20 0.35
▸ MRGPRX4 Q96LA9 2/20 0.35
▸ NPC1 O15118 1/20 0.34
▸ GAA P10253 1/20 0.34
▸ RAB9A P51151 1/20 0.34
▸ SMN1; SMN2 Q16637 1/20 0.34
▸ CDC7 O00311 1/20 0.33
▸ MAOB P27338 1/20 0.33
▸ LRRK2 Q5S007 1/20 0.33
▸ FFAR1 O14842 2/20 0.33
▸ FFAR4 Q5NUL3 1/20 0.33

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
SCHEMBL17215905 1.00 IDO1 (0.35) IDO1ENPP2MRGPRX4NPC1GAA
SCHEMBL17217917 0.90 MAOB (0.44) IDO1ENPP2MRGPRX4SMN1; SMN2MAOB
SCHEMBL17217920 0.90 MAOB (0.44) IDO1ENPP2MRGPRX4SMN1; SMN2MAOB
SCHEMBL17218932 0.89 LRRK2 (0.40) NPC1GAARAB9ASMN1; SMN2CDC7
SCHEMBL17218931 0.89 LRRK2 (0.40) NPC1GAARAB9ASMN1; SMN2CDC7
SCHEMBL17216987 0.87 IDO1 (0.41) IDO1SMN1; SMN2MAOB
SCHEMBL17217246 0.87 NPC1 (0.39) IDO1NPC1GAARAB9ASMN1; SMN2
SCHEMBL17217244 0.87 NPC1 (0.39) IDO1NPC1GAARAB9ASMN1; SMN2
SCHEMBL17216989 0.87 IDO1 (0.41) IDO1SMN1; SMN2MAOB
SCHEMBL17215460 0.85 MRGPRX4 (0.47) ENPP2MRGPRX4MAOBFFAR1FFAR4

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 2882/4885ENPP2 3655/4885MRGPRX4 1822/4885

“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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