SCHEMBL17616643

SCHEMBL17616643

Cc1ccc(OCc2ccccc2N=C=O)c(C)c1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 6/20 0.43
MAPT P10636 3/20 0.43
HPGD P15428 2/20 0.43
TSHR P16473 2/20 0.43
MAPK1 P28482 2/20 0.43
NPC1 O15118 2/20 0.43
RAB9A P51151 2/20 0.43
SMN1; SMN2 Q16637 2/20 0.43
LMNA P02545 1/20 0.43
CASP3 P42574 1/20 0.43
SENP8 Q96LD8 1/20 0.43
SENP7 Q9BQF6 1/20 0.43
SENP6 Q9GZR1 1/20 0.43
MRGPRX4 Q96LA9 1/20 0.43
FFAR4 Q5NUL3 7/20 0.39
FFAR1 O14842 4/20 0.39
CYP3A4 P08684 1/20 0.39
TDP1 Q9NUW8 1/20 0.38
KDM4E B2RXH2 1/20 0.37
NFKB1 P19838 1/20 0.37

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
SCHEMBL16273619 0.88 FFAR4 (0.41) MRGPRX4FFAR4FFAR1CYP3A4
SCHEMBL17616646 0.88 L3MBTL1 (0.45) L3MBTL1MAPTHPGDTSHRSMN1; SMN2
SCHEMBL17616618 0.87 CYP3A4 (0.42) MAPTHPGDRAB9AMRGPRX4FFAR4
SCHEMBL17616601 0.87 MAPT (0.45) L3MBTL1MAPTHPGDTSHRMAPK1
SCHEMBL17616645 0.87 MRGPRX4 (0.45) L3MBTL1MAPTHPGDNPC1RAB9A
SCHEMBL16920904 0.85 MRGPRX4 (0.43) L3MBTL1MAPTHPGDTSHRMAPK1
SCHEMBL16920899 0.84 MRGPRX4 (0.46) L3MBTL1MAPTHPGDTSHRMAPK1
SCHEMBL17616588 0.84 FFAR1 (0.41) L3MBTL1HPGDMRGPRX4FFAR4FFAR1
SCHEMBL17616598 0.83 FFAR4 (0.41) MAPTHPGDNPC1RAB9ASMN1; SMN2
SCHEMBL17616590 0.83 MRGPRX4 (0.39) MAPTHPGDLMNAMRGPRX4FFAR4

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-9675072-B2 Tetrazolinone compound and application of same SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2017-06-13 US disclosed
US-9512090-B2 Tetrazolinone compound and use thereof SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2016-12-06 US disclosed
US-20160081340-A1 TETRAZOLINONE COMPOUND AND APPLICATION 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-20160081340-A1 TETRAZOLINONE COMPOUND AND APPLICATION OF SAME CYP2E1, MT-CO2, CASP3 L3MBTL1 458/4885MAPT 3398/4885HPGD 4259/4885

“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.