SCHEMBL3762686

SCHEMBL3762686

O=C(O)CCOc1ccc2ccc(Oc3ccc(C(F)(F)F)cc3Cl)cc2c1

nearest known ligand 0.64

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 6/20 0.64
MEN1 O00255 1/20 0.51
TTR P02766 1/20 0.51
PPOX P50336 1/20 0.51
KMT2A Q03164 1/20 0.51
TDP1 Q9NUW8 1/20 0.51
PPARD Q03181 5/20 0.47
PPARA Q07869 4/20 0.47
MRGPRX4 Q96LA9 6/20 0.47
PPARG P37231 3/20 0.45

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
SCHEMBL10589748 0.86 FFAR1 (0.50) FFAR1MEN1TTRPPOXKMT2A
SCHEMBL9711441 0.86 FFAR1 (0.54) FFAR1MEN1TTRPPOXKMT2A
SCHEMBL8874528 0.84 FFAR1 (0.64) FFAR1MEN1TTRPPOXKMT2A
SCHEMBL8378906 0.79 FFAR1 (0.62) FFAR1MEN1TTRPPOXKMT2A
SCHEMBL204622 0.79 FFAR1 (0.58) FFAR1MEN1TTRPPOXKMT2A
SCHEMBL8918684 0.79 FFAR1 (0.58) FFAR1MEN1TTRPPOXKMT2A
SCHEMBL15635194 0.79 FFAR1 (0.53) FFAR1MEN1TTRPPOXKMT2A
SCHEMBL6238335 0.78 FFAR1 (0.51) FFAR1MEN1TTRPPOXKMT2A
SCHEMBL150103 0.78 FFAR1 (0.58) FFAR1MEN1TTRPPOXKMT2A
SCHEMBL10518526 0.78 FFAR1 (0.74) FFAR1MEN1TTRPPOXKMT2A

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-20100311740-A1 IMIDAZOPYRIDINE DERIVATIVES AS ACID PUMP ANTAGONISTS GLAXO GROUP LIMITED (GB) 2010-12-09 US claimed
US-5695773-A APPLYING ONTO PLANT A DILUENT AND A SOLUTION CONSISTING OF OXYNIL AND A HERBICIDE IN LIQUID STATE CFPI AGRO (FR) 1997-12-09 US claimed
US-20100311592-A1 USE OF 2-IODO-N 4-METHOXY-6-METHYL-1,3,5-TRIAZINE-2-YL CARBAMOYL BENZENESULFONAMIDE AND/OR SALTS THEREOF FOR COMBATING UNDESIRED PLANT GROWTH IN SELECTED USEFUL PLANT CROPS OR NON-CULTIVATED LAND BAYER CROPSCIENCE AG (DE) 2010-12-09 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 (2 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-20100311592-A1 USE OF 2-IODO-N 4-METHOXY-6-METHYL-1,3,5-TRIAZINE-2-YL CARBAMOYL BENZENESULFONAMIDE AND/OR SALTS THEREOF FOR COMBATING UNDESIRED PLANT GROWTH IN SELECTED USEFUL PLANT CROPS OR NON-CULTIVATED LAND PFAS, INMT, GYS2 FFAR1 2814/4885MEN1 2988/4885TTR 1065/4885
US-20100311740-A1 IMIDAZOPYRIDINE DERIVATIVES AS ACID PUMP ANTAGONISTS HRH2, GIPR, MLNR FFAR1 647/4885MEN1 4455/4885TTR 4779/4885

“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.