SCHEMBL5659599

SCHEMBL5659599

COc1ccc(CN2C(=O)C(c3cc(C)c(O)c(C)c3)(c3cc(C)c(O)c(C)c3)c3ccccc32)cc1

nearest known ligand 0.58

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
SCN9A Q15858 7/20 0.58
OPRL1 P41146 1/20 0.46
MMP12 P39900 1/20 0.46
ADAMTS5 Q9UNA0 1/20 0.46
CNR1 P21554 1/20 0.46
GPR55 Q9Y2T6 1/20 0.46
MAPT P10636 4/20 0.44
LMNA P02545 1/20 0.44
TP53 P04637 2/20 0.44
EDNRB P24530 2/20 0.44
EDNRA P25101 2/20 0.44
SMN1; SMN2 Q16637 2/20 0.44

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
SCHEMBL5661165 0.88 PTGDR2 (0.52) SCN9AMMP12ADAMTS5MAPTTP53
SCHEMBL14457619 0.87 CNR1 (0.47) SCN9ACNR1GPR55MAPTTP53
SCHEMBL14457581 0.87 SCN9A (0.51) SCN9ACNR1GPR55MAPTLMNA
SCHEMBL5659203 0.86 CNR1 (0.52) SCN9ACNR1GPR55MAPTTP53
SCHEMBL5656629 0.86 MAPT (0.47) SCN9ACNR1GPR55MAPTLMNA
SCHEMBL5659213 0.85 CNR1 (0.46) SCN9ACNR1GPR55MAPTTP53
SCHEMBL25430199 0.85 SCN9A (0.65) SCN9AOPRL1MMP12ADAMTS5MAPT
SCHEMBL5658420 0.84 MAPT (0.49) SCN9ACNR1GPR55MAPTTP53
SCHEMBL5660616 0.83 CNR1 (0.61) SCN9ACNR1GPR55MAPTTP53
SCHEMBL5659386 0.83 GFER (0.52) SCN9ACNR1GPR55MAPTLMNA

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 4 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

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 1918/4885OPRL1 267/4885MMP12 2903/4885

“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.