SCHEMBL16414547

SCHEMBL16414547

OCCCCCc1ccc2cc(F)ccc2c1

nearest known ligand 0.51

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ NAAA Q02083 1/20 0.51
▸ SLC6A2 P23975 1/20 0.45
▸ SLC6A4 P31645 1/20 0.45
▸ SLC6A3 Q01959 1/20 0.45
▸ KCNH2 Q12809 1/20 0.45
▸ BCHE P06276 5/20 0.44
▸ ACHE P22303 2/20 0.43
▸ PDE3B Q13370 1/20 0.43
▸ PDE3A Q14432 1/20 0.43
▸ P2RY12 Q9H244 1/20 0.43
▸ HDAC1 Q13547 1/20 0.42
▸ HDAC8 Q9BY41 1/20 0.42
▸ CA2 P00918 2/20 0.41
▸ CYP1A2 P05177 2/20 0.41
▸ CYP2A6 P11509 1/20 0.41
▸ IGF1R P08069 1/20 0.38
▸ ALOX15 P16050 1/20 0.38
▸ KCNH3 Q9ULD8 1/20 0.38

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
SCHEMBL16414584 1.00 NAAA (0.51) NAAASLC6A2SLC6A4SLC6A3KCNH2
SCHEMBL15351816 0.98 NAAA (0.49) NAAASLC6A2SLC6A4SLC6A3KCNH2
SCHEMBL16414413 0.93 SLC6A2 (0.47) NAAASLC6A2SLC6A4SLC6A3KCNH2
SCHEMBL19169265 0.91 NAAA (0.54) NAAASLC6A2SLC6A4SLC6A3KCNH2
SCHEMBL17448720 0.91 NAAA (0.54) NAAASLC6A2SLC6A4SLC6A3KCNH2
SCHEMBL16414923 0.85 SLC6A2 (0.50) NAAASLC6A2SLC6A4SLC6A3KCNH2
SCHEMBL16414546 0.82 NAAA (0.51) NAAASLC6A2SLC6A4SLC6A3KCNH2
SCHEMBL15352131 0.82 NAAA (0.51) NAAASLC6A2SLC6A4SLC6A3KCNH2
SCHEMBL15352326 0.82 NAAA (0.48) NAAASLC6A2SLC6A4SLC6A3KCNH2
SCHEMBL12982444 0.81 HDAC1 (0.59) NAAABCHEPDE3BPDE3AP2RY12

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 10 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2841429-B1 TETRAZOLINONE COMPOUNDS AND ITS USE AS PESTICIDES SUMITOMO CHEMICAL CO (JP) 2020-10-21 — — EP disclosed
EP-3040332-B1 TETRAZOLINONE COMPOUND AND USE OF SAME SUMITOMO CHEMICAL CO (JP) 2020-06-03 — — EP disclosed
US-9730448-B2 Tetrazolinone compound and use of same SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2017-08-15 — — US disclosed
EP-2841433-B1 TETRAZOLINONE COMPOUNDS AND ITS USE SUMITOMO CHEMICAL CO (JP) 2017-06-21 — — EP disclosed
US-9565856-B2 Tetrazolinone compounds and its use as pesticides SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2017-02-14 — — US disclosed
US-20160205935-A1 TETRAZOLINONE COMPOUND AND USE OF SAME SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2016-07-21 — — US disclosed
EP-3040332-A1 TETRAZOLINONE COMPOUND AND USE OF SAME Sumitomo Chemical Company, Limited (JP) 2016-07-06 — — EP disclosed
US-9380782-B2 Tetrazolinone compounds and its use SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2016-07-05 — — US disclosed
US-20150051171-A1 TETRAZOLINONE COMPOUNDS AND ITS USE AS PESTICIDES SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2015-02-19 — — US disclosed
US-20150031733-A1 TETRAZOLINONE COMPOUNDS AND ITS USE SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2015-01-29 — — US 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 (3 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-20150031733-A1 TETRAZOLINONE COMPOUNDS AND ITS USE CBR3, CYP51A1, CYP8B1 NAAA 1847/4885SLC6A2 4752/4885SLC6A4 4011/4885
US-20150051171-A1 TETRAZOLINONE COMPOUNDS AND ITS USE AS PESTICIDES CBR3, CYCS, CBR1 NAAA 2492/4885SLC6A2 4792/4885SLC6A4 4223/4885
US-20160205935-A1 TETRAZOLINONE COMPOUND AND USE OF SAME MT-CO1, UQCRB, RPS20 NAAA 3352/4885SLC6A2 4820/4885SLC6A4 4481/4885

“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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