SCHEMBL922574

SCHEMBL922574

COCc1ccc(C(=O)NCc2ccc(Oc3cc(C)cs3)cc2)c(N)n1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KLKB1 P03952 4/20 0.41
▸ CHRM4 P08173 2/20 0.39
▸ KDM4E B2RXH2 2/20 0.39
▸ ALDH1A1 P00352 2/20 0.39
▸ HPGD P15428 2/20 0.39
▸ FLT1 P17948 1/20 0.39
▸ LRRK2 Q5S007 1/20 0.39
▸ HSD17B10 Q99714 1/20 0.39
▸ POLB P06746 2/20 0.39
▸ CYP3A4 P08684 2/20 0.39
▸ CYP1A2 P05177 1/20 0.39
▸ CYP2C9 P11712 1/20 0.39
▸ CYP2C19 P33261 1/20 0.39
▸ KLK1 P06870 2/20 0.38
▸ PTGER4 P35408 1/20 0.38
▸ KMT2A Q03164 1/20 0.38
▸ MAPK14 Q16539 2/20 0.38
▸ SMN1; SMN2 Q16637 3/20 0.37
▸ LMNA P02545 1/20 0.37
▸ EGLN1 Q9GZT9 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
SCHEMBL920230 0.91 TP53 (0.39) KLKB1CHRM4KDM4EALDH1A1HPGD
SCHEMBL920314 0.87 ADORA2A (0.42) KLKB1CHRM4KDM4EALDH1A1HPGD
SCHEMBL922079 0.87 MAPK14 (0.50) CHRM4KDM4EALDH1A1HPGDFLT1
SCHEMBL920614 0.85 PTGER4 (0.43) KLKB1CHRM4KDM4EALDH1A1HPGD
SCHEMBL922841 0.84 EGLN1 (0.49) CHRM4KDM4EALDH1A1HPGDFLT1
SCHEMBL921782 0.84 MAPK14 (0.45) KLKB1KDM4EALDH1A1HPGDHSD17B10
SCHEMBL920942 0.84 CHRM4 (0.39) KLKB1CHRM4KDM4EALDH1A1HPGD
SCHEMBL920018 0.83 TP53 (0.41) CHRM4ALDH1A1HPGDFLT1LRRK2
SCHEMBL919997 0.83 MAPK14 (0.50) KLKB1KDM4EALDH1A1HPGDCYP3A4
SCHEMBL920779 0.82 LIPG (0.51) POLBCYP3A4PTGER4MAPK14SMN1; SMN2

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-20110009454-A1 COMPOSITION FOR AGRICULTURAL USE FOR CONTROLLING OR PREVENTING PLANT DISEASES CAUSED BY PLANT PATHOGENS SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2011-01-13 — — US disclosed
EP-2248423-A1 COMPOSITION FOR AGRICULTURAL USE FOR CONTROLLING OR PREVENTING PLANT DISEASES CAUSED BY PLANT PATHOGENS Sumitomo Chemical Company, Limited (JP) 2010-11-10 — — EP 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-20110009454-A1 COMPOSITION FOR AGRICULTURAL USE FOR CONTROLLING OR PREVENTING PLANT DISEASES CAUSED BY PLANT PATHOGENS WIZ, TST, NAT1 KLKB1 4691/4885CHRM4 4158/4885KDM4E 3657/4885

“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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