SCHEMBL11903387

SCHEMBL11903387

COc1c(Cl)ccc(-c2nc(C(=O)OCc3ccccc3)c3c(C)c[nH]c3n2)c1F

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ DHODH Q02127 1/20 0.36
▸ GAA P10253 1/20 0.35
▸ TSHR P16473 2/20 0.34
▸ RAB9A P51151 1/20 0.34
▸ SMN1; SMN2 Q16637 1/20 0.34
▸ KMT2A Q03164 2/20 0.33
▸ TDP1 Q9NUW8 2/20 0.33
▸ GPBAR1 Q8TDU6 1/20 0.33
▸ SLC6A2 P23975 1/20 0.33
▸ SLC6A3 Q01959 1/20 0.33
▸ HSD17B10 Q99714 1/20 0.33
▸ AURKA O14965 1/20 0.33
▸ ALOX5AP P20292 1/20 0.33
▸ FEN1 P39748 1/20 0.33
▸ LMNA P02545 1/20 0.33
▸ HPGD P15428 1/20 0.33
▸ FTO Q9C0B1 1/20 0.33
▸ CASP3 P42574 1/20 0.33
▸ SENP8 Q96LD8 1/20 0.33
▸ SENP7 Q9BQF6 1/20 0.33

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
SCHEMBL11903334 0.89 JAK3 (0.38) SMN1; SMN2KMT2AHSD17B10
SCHEMBL1654718 0.87 TAS1R3 (0.34) KMT2AHSD17B10
SCHEMBL11903320 0.86 TDP1 (0.35) TSHRRAB9ASMN1; SMN2KMT2ATDP1
SCHEMBL11902585 0.85 DHODH (0.39) DHODHGAATSHRRAB9ASMN1; SMN2
SCHEMBL1654720 0.85 KMO (0.41) SMN1; SMN2KMT2AHSD17B10
SCHEMBL11903222 0.85 SMN1; SMN2 (0.34) SMN1; SMN2KMT2AHSD17B10
SCHEMBL11902410 0.84 SMN1; SMN2 (0.34) GAATSHRSMN1; SMN2TDP1
SCHEMBL11902933 0.84 SMN1; SMN2 (0.34) TSHRSMN1; SMN2KMT2ATDP1
SCHEMBL11902785 0.83 SMN1; SMN2 (0.40) GAASMN1; SMN2LMNA
SCHEMBL11902200 0.83 MEP1B (0.34) —

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-20120202690-A1 HERBICIDAL COMPOUNDS SYNGENTA LIMITED (US) 2012-08-09 — — US disclosed
US-20120202690-A1 HERBICIDAL COMPOUNDS SYNGENTA LIMITED (US) 2012-08-09 — — US disclosed
US-20120202690-A1 HERBICIDAL COMPOUNDS SYNGENTA LIMITED (US) 2012-08-09 — — 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-20120202690-A1 HERBICIDAL COMPOUNDS DDT, HAO2, HAAO DHODH 55/4885GAA 365/4885TSHR 2970/4885

“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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