SCHEMBL17806065

SCHEMBL17806065

Cc1cccc(-c2ccc(OCc3c(C)cccc3-n3nnn(C)c3=O)c(C)c2)c1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MRGPRX4 Q96LA9 2/20 0.40
MAPT P10636 4/20 0.34
L3MBTL1 Q9Y468 3/20 0.34
HPGD P15428 3/20 0.33
MAPK1 P28482 3/20 0.33
TSHR P16473 2/20 0.33
FFAR4 Q5NUL3 1/20 0.33
NPC1 O15118 1/20 0.33
LMNA P02545 1/20 0.33
CASP3 P42574 1/20 0.33
RAB9A P51151 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
SENP8 Q96LD8 1/20 0.33
SENP7 Q9BQF6 1/20 0.33
SENP6 Q9GZR1 1/20 0.33
SYK P43405 1/20 0.32
NR1H4 Q96RI1 2/20 0.32
GRIN1 Q05586 2/20 0.32
GRIN2B Q13224 2/20 0.32
MAPK14 Q16539 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
SCHEMBL16442865 0.93 MRGPRX4 (0.40) MRGPRX4MAPTL3MBTL1HPGDMAPK1
SCHEMBL16442780 0.93 MRGPRX4 (0.47) MRGPRX4MAPTL3MBTL1HPGDMAPK1
SCHEMBL17806097 0.92 MRGPRX4 (0.39) MRGPRX4MAPTL3MBTL1NR1H4GRIN1
SCHEMBL16442778 0.91 MRGPRX4 (0.38) MRGPRX4MAPTHPGDMAPK1TSHR
SCHEMBL16442863 0.91 MRGPRX4 (0.43) MRGPRX4MAPTL3MBTL1HPGDMAPK1
SCHEMBL16385245 0.90 MRGPRX4 (0.35) MRGPRX4NR1H4GRIN1GRIN2B
SCHEMBL17806069 0.90 MRGPRX4 (0.39) MRGPRX4GRIN1GRIN2BPTGER1
SCHEMBL16442841 0.90 MRGPRX4 (0.39) MRGPRX4MAPTMAPK1FFAR4NPC1
SCHEMBL17806066 0.90 MRGPRX4 (0.36) MRGPRX4MAPTL3MBTL1SMN1; SMN2NR1H4
SCHEMBL16442808 0.89 L3MBTL1 (0.38) MRGPRX4MAPTL3MBTL1HPGDMAPK1

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-9512090-B2 Tetrazolinone compound and use thereof SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2016-12-06 US disclosed
US-20160159755-A1 TETRAZOLINONE COMPOUND AND USE THEREOF SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2016-06-09 US disclosed
US-20160159755-A1 TETRAZOLINONE COMPOUND AND USE THEREOF SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2016-06-09 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-20160159755-A1 TETRAZOLINONE COMPOUND AND USE THEREOF CYP1A1, CASP1, TCOF1 MRGPRX4 1910/4885MAPT 2985/4885L3MBTL1 170/4885

“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.