SCHEMBL4099286

SCHEMBL4099286

N#Cc1ccc(Oc2c(C3CC3)nn(Cc3ccon3)c2C2CC2)cc1

nearest known ligand 0.40

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
PGR P06401 2/20 0.40
ICMT O60725 1/20 0.31
ALDH1A1 P00352 1/20 0.31
ALOX5AP P20292 1/20 0.31
FEN1 P39748 1/20 0.31
HRH3 Q9Y5N1 2/20 0.31
POLB P06746 1/20 0.30
SIGMAR1 Q99720 1/20 0.30

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
SCHEMBL4104316 0.89 PGR (0.42) PGRICMTALDH1A1ALOX5APFEN1
SCHEMBL4110152 0.89 PGR (0.38) PGRICMTALDH1A1ALOX5APFEN1
SCHEMBL4108041 0.82 PGR (0.41) PGRICMTALOX5APFEN1HRH3
SCHEMBL4709063 0.81 PGR (0.47) PGRICMTALOX5APFEN1HRH3
SCHEMBL4609093 0.80 PGR (0.46) PGRICMTALOX5APFEN1HRH3
SCHEMBL4609487 0.78 PGR (0.46) PGRICMTALOX5APFEN1HRH3
SCHEMBL4959617 0.77 PGR (0.50) PGRALDH1A1POLB
SCHEMBL4608270 0.76 PGR (0.62) PGRALOX5APFEN1HRH3
SCHEMBL4103189 0.76 PGR (0.49) PGRALOX5APFEN1POLB
SCHEMBL4114841 0.75 LMNA (0.32)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090099209-A1 Compounds Useful in Therapy PFIZER INC 2009-04-16 US disclosed
US-7482375-B2 Compounds useful in therapy PFIZER INC. (US) 2009-01-27 US disclosed
EP-1874732-A1 PYRAZOLE DERIVATIVES AS PROGESTERONE RECEPTOR ANTAGONISTS Pfizer Limited (GB) 2008-01-09 EP disclosed
WO-2006111856-A1 PYRAZOLE DERIVATIVES AS PROGESTERONE RECEPTOR ANTAGONISTS PFIZER LIMITED (GB) 2006-10-26 WO disclosed
US-20060241125-A1 Compounds useful in therapy BRADLEY PAUL A 2006-10-26 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 (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-20060241125-A1 Compounds useful in therapy CBR3, GPER1, CBR1 PGR 57/4885ICMT 3479/4885ALDH1A1 881/4885
US-20090099209-A1 Compounds Useful in Therapy CBR3, CBR1, GPER1 PGR 87/4885ICMT 3463/4885ALDH1A1 974/4885

“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.