SCHEMBL17219553

SCHEMBL17219553

Clc1cccc([C]=NOCc2ccc(-c3ccccc3)cc2)c1

nearest known ligand 0.43

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ TAAR1 Q96RJ0 2/20 0.43
▸ MAOB P27338 5/20 0.40
▸ GPR34 Q9UPC5 2/20 0.39
▸ IDO1 P14902 4/20 0.39
▸ AGXT P21549 4/20 0.39
▸ GSTP1 P09211 1/20 0.38
▸ CYP3A4 P08684 2/20 0.37
▸ ADAMTS5 Q9UNA0 1/20 0.37
▸ HCAR2 Q8TDS4 1/20 0.36
▸ MAPT P10636 1/20 0.36
▸ RXRA P19793 2/20 0.35
▸ RXRB P28702 2/20 0.35
▸ RXRG P48443 2/20 0.35
▸ NPC1 O15118 1/20 0.35
▸ RAB9A P51151 1/20 0.35

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
SCHEMBL17219552 1.00 TAAR1 (0.43) TAAR1MAOBGPR34IDO1AGXT
SCHEMBL17219133 0.91 CYP3A4 (0.45) TAAR1MAOBIDO1AGXTCYP3A4
SCHEMBL17219130 0.91 CYP3A4 (0.45) TAAR1MAOBIDO1AGXTCYP3A4
SCHEMBL17218151 0.90 AGXT (0.45) TAAR1MAOBIDO1AGXTCYP3A4
SCHEMBL17218153 0.90 AGXT (0.45) TAAR1MAOBIDO1AGXTCYP3A4
SCHEMBL17218163 0.88 MAOB (0.42) TAAR1MAOBIDO1AGXTCYP3A4
SCHEMBL17218165 0.88 MAOB (0.42) TAAR1MAOBIDO1AGXTCYP3A4
SCHEMBL17219737 0.85 CYP3A4 (0.51) TAAR1MAOBIDO1AGXTCYP3A4
SCHEMBL17219738 0.85 CYP3A4 (0.51) TAAR1MAOBIDO1AGXTCYP3A4
SCHEMBL17217277 0.85 IDO1 (0.48) TAAR1IDO1AGXTGSTP1NPC1

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 TAAR1 21/4885MAOB 3611/4885GPR34 3219/4885

“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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