SCHEMBL5878330

SCHEMBL5878330

CC1=CC(C)(C)Nc2ccc3c(c21)C(C1C=CCCCCC1)Oc1c(F)cc(F)cc1-3

nearest known ligand 0.93

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ PGR P06401 16/20 0.93
▸ NR3C1 P04150 8/20 0.73
▸ AR P10275 4/20 0.73
▸ NR3C2 P08235 2/20 0.73
▸ ESR1 P03372 1/20 0.45
▸ ESR2 Q92731 1/20 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
SCHEMBL5878326 1.00 PGR (0.93) PGRNR3C1ARNR3C2ESR1
SCHEMBL6091320 0.99 PGR (0.95) PGRNR3C1ARNR3C2ESR1
SCHEMBL5889060 0.83 PGR (0.76) PGRNR3C1ARNR3C2
SCHEMBL5360104 0.78 PGR (0.71) PGRNR3C1ARNR3C2
SCHEMBL5878671 0.78 PGR (1.00) PGRNR3C1ARNR3C2ESR1
SCHEMBL5889137 0.78 PGR (0.70) PGRNR3C1ARNR3C2ESR1
SCHEMBL5878865 0.77 PGR (0.66) PGRNR3C1ARNR3C2ESR1
SCHEMBL5373396 0.77 PGR (0.64) PGRNR3C1ARNR3C2
SCHEMBL5889160 0.77 PGR (0.67) PGRNR3C1ARNR3C2ESR1
SCHEMBL5358795 0.76 PGR (0.74) PGRNR3C1ARNR3C2ESR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-2006508076-A — — 2006-03-09 — — JP claimed
EP-1551845-A1 5-CYCLOALKENYL 5 i H /i -CHROMENO 3,4-F QUINOLINE DERIV ATIVES AS SELECTIVE PROGESTERONE RECEPTOR MODULATOR COMPOUNDS LIGAND PHARMACEUTICALS, INC. (US) 2005-07-13 — — EP claimed
WO-2004033460-A1 5-CYCLOALKENYL 5H-CHROMENO[3,4-F]QUINOLINE DERIVATIVES AS SELECTIVE PROGESTERONE RECEPTOR MODULATOR COMPOUNDS LIGAND PHARMACEUTICALS INCORPORATED (US) 2004-04-22 — — WO claimed
US-20060194827-A1 5-Cycloalkenyl 5H-chromeno[3,4-f]quinoline derivatives as selective progesterone receptor modulator compounds LIGAND PHARMACEUTICALS, INCORPORATED 2006-08-31 — — US disclosed
EP-1551845-A1 5-CYCLOALKENYL 5 i H /i -CHROMENO 3,4-F QUINOLINE DERIV ATIVES AS SELECTIVE PROGESTERONE RECEPTOR MODULATOR COMPOUNDS LIGAND PHARMACEUTICALS, INC. (US) 2005-07-13 — — EP disclosed
US-20040152718-A1 5-cycloalkenyl 5H-chromeno[3,4-f]quinoline derivatives as selective progesterone receptor modulator compounds CITIBANK, N.A., AS ADMINISTRATIVE AGENT 2004-08-05 — — US disclosed
WO-2004033460-A1 5-CYCLOALKENYL 5H-CHROMENO[3,4-F]QUINOLINE DERIVATIVES AS SELECTIVE PROGESTERONE RECEPTOR MODULATOR COMPOUNDS LIGAND PHARMACEUTICALS INCORPORATED (US) 2004-04-22 — — 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 (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-20060194827-A1 5-Cycloalkenyl 5H-chromeno[3,4-f]quinoline derivatives as selective progesterone receptor modulator compounds PGR, GPER1, FSHR PGR 1/4885NR3C1 13/4885AR 88/4885
US-20040152718-A1 5-cycloalkenyl 5H-chromeno[3,4-f]quinoline derivatives as selective progesterone receptor modulator compounds PGR, GPER1, PGRMC2 PGR 1/4885NR3C1 14/4885AR 52/4885

“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.

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