SCHEMBL5656691

SCHEMBL5656691

Cc1cc(C2(O)C(=O)N(c3cccc(OC(F)(F)F)c3)c3ccccc32)cc(C)c1O

nearest known ligand 0.37

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
SCN9A Q15858 1/20 0.37
CHRM5 P08912 1/20 0.37
OPRL1 P41146 1/20 0.36
EDNRB P24530 1/20 0.36
EDNRA P25101 1/20 0.36
PDE10A Q9Y233 1/20 0.35
NPY5R Q15761 1/20 0.35
CCKBR P32239 1/20 0.35
CETP P11597 6/20 0.34
AMPD2 Q01433 1/20 0.34
METAP2 P50579 1/20 0.34
CTSD P07339 1/20 0.34
BACE1 P56817 1/20 0.34
BACE2 Q9Y5Z0 1/20 0.34
TOP2A P11388 1/20 0.34
HPD P32754 1/20 0.34

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
SCHEMBL5661865 0.87 SCN9A (0.48) SCN9A
SCHEMBL5658582 0.86 PDE10A (0.34) SCN9ACHRM5OPRL1EDNRBEDNRA
SCHEMBL5659353 0.84 ALDH1A1 (0.40)
SCHEMBL5659844 0.83 OPRL1 (0.33) OPRL1EDNRBEDNRAPDE10ANPY5R
SCHEMBL5660992 0.82 OPRL1 (0.35) CHRM5OPRL1EDNRBEDNRACCKBR
SCHEMBL5661607 0.82 OPRL1 (0.33) OPRL1EDNRBEDNRANPY5RCCKBR
SCHEMBL5659652 0.80 CETP (0.34) OPRL1EDNRBEDNRACCKBRCETP
SCHEMBL5656443 0.75 MAPT (0.44) SCN9A
SCHEMBL14457630 0.75 SCN9A (0.43) SCN9A
SCHEMBL5660687 0.74 AR (0.46) NPY5R

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7250442-B2 Dihydroindol-2-one derivatives as steroid hormone nuclear receptor modulators ELI LILLY AND COMPANY (US) 2007-07-31 US disclosed
US-7250442-B2 Dihydroindol-2-one derivatives as steroid hormone nuclear receptor modulators ELI LILLY AND COMPANY (US) 2007-07-31 US disclosed
US-7250442-B2 Dihydroindol-2-one derivatives as steroid hormone nuclear receptor modulators ELI LILLY AND COMPANY (US) 2007-07-31 US disclosed
US-20050054712-A1 Dihydroindol-2-one derivatives as steroid hormone nuclear receptor modulators ELI LILLY AND COMPANY 2005-03-10 US disclosed
EP-1487792-A1 DIHYDROINDOL-2-ONE DERIVATIVES AS STEROID HORMONE NUCLEAR RECEPTOR MODULATORS ELI LILLY AND COMPANY (US) 2004-12-22 EP disclosed
WO-2003078394-A1 DIHYDROINDOL-2-ONE DERIVATIVES AS STEROID HORMONE NUCLEAR RECEPTOR MODULATORS ELI LILLY AND COMPANY (US) 2003-09-25 WO 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-20050054712-A1 Dihydroindol-2-one derivatives as steroid hormone nuclear receptor modulators NR3C2, NR5A1, NR5A2 SCN9A 1918/4885CHRM5 1591/4885OPRL1 267/4885

“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.