SCHEMBL17614552

SCHEMBL17614552

Cc1ccc(-c2cccc(OCc3c(C)cccc3-n3nnn(C)c3=O)n2)cc1F

nearest known ligand 0.37

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
KMO O15229 2/20 0.37
HSD11B1 P28845 1/20 0.36
FFAR4 Q5NUL3 5/20 0.33
GLP1R P43220 1/20 0.33
CYP11B1 P15538 3/20 0.32
CYP11B2 P19099 3/20 0.32
PPARG P37231 1/20 0.32
HTR7 P34969 1/20 0.32
ABL1 P00519 1/20 0.31
GRIN2B Q13224 2/20 0.31
NR4A2 P43354 1/20 0.31
DHODH Q02127 1/20 0.31
RXRA P19793 1/20 0.31
GRIN1 Q05586 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
SCHEMBL16206096 0.92 GABRA5 (0.35) KMOHTR7GRIN2BGRIN1
SCHEMBL17614555 0.92 FFAR4 (0.35) FFAR4GLP1RCYP11B1CYP11B2HTR7
SCHEMBL16206032 0.91 ALDH1A1 (0.40) FFAR4GLP1RNR4A2DHODH
SCHEMBL16205991 0.90 GABRA5 (0.35) CYP11B1CYP11B2HTR7
SCHEMBL17614527 0.88 GRM2 (0.36) KMOHTR7
SCHEMBL17614537 0.88 HTR7 (0.33) CYP11B1CYP11B2HTR7
SCHEMBL16206095 0.88 HTR7 (0.34) CYP11B1CYP11B2HTR7
SCHEMBL16205996 0.86 GABRA5 (0.36) HTR7
SCHEMBL16206004 0.86 HTR7 (0.33) HSD11B1CYP11B1CYP11B2HTR7
SCHEMBL16206109 0.85 SMN1; SMN2 (0.41)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9867372-B2 Tetrazolinone compound and use of same SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2018-01-16 US disclosed
US-20160081339-A1 TETRAZOLINONE COMPOUND AND USE OF SAME SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2016-03-24 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 (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-20160081339-A1 TETRAZOLINONE COMPOUND AND USE OF SAME MT-CO1, SOD1, MT-CO2 KMO 1060/4885HSD11B1 903/4885FFAR4 2754/4885

“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.