SCHEMBL6808609

SCHEMBL6808609

COC(=O)c1ccccc1Oc1ccc(C(F)(F)F)cc1Nc1c(C)cc(CN)cc1C(=O)O

nearest known ligand 0.48

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
TAS2R14 Q9NYV8 4/20 0.48
CCR1 P32246 1/20 0.46
CCR2 P41597 1/20 0.46
KDM4E B2RXH2 1/20 0.40
HPGD P15428 1/20 0.40
MRGPRX4 Q96LA9 2/20 0.40
AKR1B1 P15121 1/20 0.39
AKR1C4 P17516 1/20 0.39
AKR1C3 P42330 1/20 0.39
AKR1C2 P52895 1/20 0.39
AKR1C1 Q04828 1/20 0.39
CFTR P13569 1/20 0.39
HTT P42858 1/20 0.39
MAPT P10636 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
SCN8A Q9UQD0 1/20 0.38
SCN10A Q9Y5Y9 1/20 0.38

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
SCHEMBL6808607 0.85 CCR1 (0.43) TAS2R14CCR1CCR2KDM4EHPGD
Hydrochloric Acid SCHEMBL6141535 0.80 CCR2 (0.53) TAS2R14CCR1CCR2MRGPRX4AKR1B1
SCHEMBL16302025 0.77 SCN8A (0.53) TAS2R14MRGPRX4CFTRMAPTTDP1
SCHEMBL9119563 0.77 RXFP1 (0.49) TAS2R14CCR1CCR2KDM4EHPGD
SCHEMBL6141415 0.75 TAS2R14 (0.67) TAS2R14CCR1CCR2AKR1B1AKR1C4
SCHEMBL9122911 0.73 CCR1 (0.48) TAS2R14CCR1CCR2KDM4EHPGD
SCHEMBL6141345 0.73 TAS2R14 (0.49) TAS2R14KDM4EHPGDMRGPRX4AKR1B1
SCHEMBL6802907 0.73 TAS2R14 (0.49) TAS2R14KDM4EHPGDMRGPRX4AKR1B1
SCHEMBL1365182 0.73 CFTR (0.64) CCR1CCR2KDM4EHPGDMRGPRX4
SCHEMBL9118404 0.71 RXFP1 (0.53) TAS2R14CCR1CCR2KDM4EHPGD

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040142993-A1 Inhibitors of HCV NS5B polymerase PHARMACIA & UPJOHN COMPANY 2004-07-22 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-20040142993-A1 Inhibitors of HCV NS5B polymerase POLRMT, POLR1E, CTDSP1 TAS2R14 4336/4885CCR1 1494/4885CCR2 2656/4885

“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.