SCHEMBL11902585

SCHEMBL11902585

COc1c(Cl)ccc(-c2cc3[nH]cc(C)c3c(C(=O)OCc3ccccc3)n2)c1F

nearest known ligand 0.39

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ DHODH Q02127 5/20 0.39
▸ GAA P10253 1/20 0.36
▸ ALOX5AP P20292 1/20 0.36
▸ FEN1 P39748 1/20 0.36
▸ L3MBTL1 Q9Y468 1/20 0.36
▸ RAB9A P51151 2/20 0.35
▸ SMN1; SMN2 Q16637 2/20 0.35
▸ LMNA P02545 1/20 0.35
▸ MAPK10 P53779 1/20 0.35
▸ HSD17B10 Q99714 1/20 0.35
▸ GPBAR1 Q8TDU6 1/20 0.35
▸ FTO Q9C0B1 1/20 0.34
▸ CTSA P10619 1/20 0.34
▸ TSHR P16473 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
SCHEMBL1656974 0.89 GLP1R (0.35) GAASMN1; SMN2
SCHEMBL1654723 0.87 NR4A2 (0.36) —
SCHEMBL11903199 0.87 POLB (0.36) L3MBTL1RAB9ALMNAHSD17B10TSHR
SCHEMBL11902825 0.85 KMO (0.43) HSD17B10
SCHEMBL11902297 0.85 PTGES (0.36) L3MBTL1SMN1; SMN2
SCHEMBL11903206 0.85 PKM (0.35) L3MBTL1SMN1; SMN2LMNAHSD17B10TSHR
SCHEMBL11903387 0.85 DHODH (0.36) DHODHGAAALOX5APFEN1RAB9A
SCHEMBL11903304 0.85 ABCB11 (0.34) SMN1; SMN2
SCHEMBL11913427 0.84 SMN1; SMN2 (0.37) GAARAB9ASMN1; SMN2LMNA
SCHEMBL11903307 0.83 PTGES (0.32) SMN1; SMN2CTSA

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 365/4885ALOX5AP 996/4885

“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.

Send feedback