SCHEMBL17217381

SCHEMBL17217381

CCc1ccc(CO/N=[C]\c2cccc(Br)c2)cc1

nearest known ligand 0.39

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ MAOB P27338 9/20 0.39
▸ IDO1 P14902 2/20 0.35
▸ AGXT P21549 2/20 0.35
▸ TAAR1 Q96RJ0 1/20 0.33
▸ SIGMAR1 Q99720 2/20 0.32
▸ CYP2A6 P11509 1/20 0.32
▸ FFAR1 O14842 1/20 0.32
▸ FFAR4 Q5NUL3 1/20 0.32
▸ NPC1 O15118 1/20 0.32
▸ LMNA P02545 1/20 0.32
▸ RAB9A P51151 1/20 0.32
▸ SMN1; SMN2 Q16637 1/20 0.32
▸ L3MBTL1 Q9Y468 1/20 0.32
▸ PPARG P37231 1/20 0.31
▸ PPARA Q07869 1/20 0.31
▸ RXRA P19793 1/20 0.31
▸ RXRB P28702 1/20 0.31

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
SCHEMBL17217382 1.00 MAOB (0.39) MAOBIDO1AGXTTAAR1SIGMAR1
SCHEMBL17219390 0.90 IDO1 (0.41) MAOBIDO1AGXTTAAR1SIGMAR1
SCHEMBL17219393 0.90 IDO1 (0.41) MAOBIDO1AGXTTAAR1SIGMAR1
SCHEMBL17218110 0.89 MAOB (0.52) MAOBIDO1AGXTNPC1LMNA
SCHEMBL17218107 0.89 MAOB (0.52) MAOBIDO1AGXTNPC1LMNA
SCHEMBL17216860 0.87 MAOB (0.44) MAOBIDO1AGXTNPC1RAB9A
SCHEMBL17216862 0.87 MAOB (0.44) MAOBIDO1AGXTNPC1RAB9A
SCHEMBL17217972 0.87 MAOB (0.49) MAOBIDO1AGXTTAAR1FFAR1
SCHEMBL17217973 0.87 MAOB (0.49) MAOBIDO1AGXTTAAR1FFAR1
SCHEMBL17215896 0.87 TP53 (0.35) SIGMAR1CYP2A6FFAR1NPC1LMNA

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.

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