SCHEMBL16690382

SCHEMBL16690382

Cc1cccc(-n2nnn(C)c2=O)c1OCc1ccccc1Oc1ccccc1

nearest known ligand 0.37

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 1/20 0.37
P2RX3 P56373 1/20 0.37
FAAH O00519 1/20 0.35
PPARG P37231 1/20 0.35
RIPK1 Q13546 1/20 0.34
SLC6A2 P23975 1/20 0.34
SLC6A4 P31645 1/20 0.34
NPBWR1 P48145 2/20 0.33
PTGDR2 Q9Y5Y4 1/20 0.33
ELANE P08246 1/20 0.33
CYP19A1 P11511 1/20 0.33
HRH1 P35367 1/20 0.33
HCRTR1 O43613 1/20 0.32
HCRTR2 O43614 1/20 0.32
MAPT P10636 1/20 0.32
MCHR1 Q99705 1/20 0.32
BRD4 O60885 1/20 0.32

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
SCHEMBL16690383 0.87 NOTUM (0.38) MAPT
SCHEMBL16690347 0.85 PKM (0.41) FFAR1PPARGNPBWR1MAPT
SCHEMBL16690381 0.83 FFAR1 (0.43) FFAR1P2RX3FAAH
SCHEMBL16690384 0.83 SCN8A (0.43) FFAR1MAPTBRD4
SCHEMBL16690405 0.82 PKM (0.43) MAPTBRD4
SCHEMBL18037158 0.79 TP53 (0.36) FAAHMAPTBRD4
SCHEMBL16690379 0.78 MAPT (0.36) MAPT
SCHEMBL16690344 0.78 PKM (0.39) MAPT
SCHEMBL16442879 0.77 SLC22A12 (0.36) FFAR1PPARGMAPTBRD4
SCHEMBL16683839 0.77 LMNA (0.41) PPARGSLC6A2SLC6A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20160249617-A1 TETRAZOLINONE COMPOUND AND USE THEREOF SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2016-09-01 US disclosed
US-20160249617-A1 TETRAZOLINONE COMPOUND AND USE THEREOF SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2016-09-01 US disclosed
WO-2015064727-A1 TETRAZOLINONE COMPOUND AND APPLICATION FOR SAME 住友化学株式会社 2015-05-07 WO 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-20160249617-A1 TETRAZOLINONE COMPOUND AND USE THEREOF TCOF1, TAOK2, CYC1 FFAR1 919/4885P2RX3 3097/4885FAAH 4116/4885

“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.