SCHEMBL4628810

SCHEMBL4628810

CC(C)(CC(O)(CNc1cccc2c1cnn2-c1ccc(F)nc1)C(F)(F)F)C1=COC(Cc2ccccc2)O1

nearest known ligand 0.46

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
NR3C1 P04150 19/20 0.46
CCR1 P32246 1/20 0.39
PGR P06401 1/20 0.38
CYP3A4 P08684 1/20 0.38
CYP2C9 P11712 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
SCHEMBL4629928 0.93 NR3C1 (0.54) NR3C1PGR
SCHEMBL4630426 0.81 NR3C1 (0.42) NR3C1PGR
SCHEMBL4628521 0.79 NR3C1 (0.39) NR3C1PGR
SCHEMBL14086563 0.78 NR3C1 (0.53) NR3C1PGR
SCHEMBL4629080 0.77 NR3C1 (0.61) NR3C1PGR
SCHEMBL4735534 0.77 NR3C1 (0.47) NR3C1PGR
SCHEMBL4628801 0.76 NR3C1 (0.44) NR3C1PGRCYP3A4CYP2C9
SCHEMBL4627623 0.76 NR3C1 (0.48) NR3C1CCR1PGR
SCHEMBL4629065 0.76 NR3C1 (0.48) NR3C1PGR
SCHEMBL6408234 0.75 NR3C1 (0.38) NR3C1PGR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080188666-A1 LINEAR PHENYL-SUBSTITUTED INDAZOLES AND INDOLES, A PROCESS FOR THEIR PRODUCTION AND THEIR USE AS ANTI-INFLAMMATORY AGENTS ASTRAZENECA AB (SE) 2008-08-07 US disclosed
EP-1921067-A1 Indole and indazole derivatives as anti-inflammatory agents Bayer Schering Pharma Aktiengesellschaft (DE) 2008-05-14 EP 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-20080188666-A1 LINEAR PHENYL-SUBSTITUTED INDAZOLES AND INDOLES, A PROCESS FOR THEIR PRODUCTION AND THEIR USE AS ANTI-INFLAMMATORY AGENTS IDO1, IL1B, IDO2 NR3C1 1243/4885CCR1 755/4885PGR 1611/4885

“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.