SCHEMBL14670184

SCHEMBL14670184

CC=C[C@]1(O)CCC2C3CCC4=CC(=O)CCC4=C3[C@@H](c3ccc(C(=O)C4CC4)cc3)C[C@@]21C

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ AR P10275 4/20 0.60
▸ NR3C1 P04150 13/20 0.57
▸ PGR P06401 12/20 0.57
▸ ESR1 P03372 2/20 0.57
▸ ESR2 Q92731 2/20 0.57
▸ THRA P10827 1/20 0.57
▸ CYP3A4 P08684 3/20 0.55
▸ CYP2D6 P10635 3/20 0.55
▸ CYP2C19 P33261 3/20 0.55
▸ CYP2C9 P11712 3/20 0.55
▸ CYP1A2 P05177 2/20 0.55
▸ MAPK1 P28482 2/20 0.55
▸ TDP1 Q9NUW8 2/20 0.55
▸ LMNA P02545 2/20 0.55
▸ MEN1 O00255 1/20 0.55
▸ TP53 P04637 1/20 0.55
▸ ALOX15 P16050 1/20 0.55
▸ NFKB1 P19838 1/20 0.55
▸ THPO P40225 1/20 0.55
▸ KMT2A Q03164 1/20 0.55

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
SCHEMBL14666086 0.92 AR (0.57) ARNR3C1PGRESR1ESR2
SCHEMBL14656547 0.92 AR (0.57) ARNR3C1PGRESR1ESR2
SCHEMBL20235298 0.92 AR (0.57) ARNR3C1PGRESR1ESR2
SCHEMBL5395107 0.92 AR (0.71) ARNR3C1PGRESR1ESR2
SCHEMBL5395109 0.92 AR (0.71) ARNR3C1PGRESR1ESR2
SCHEMBL9647584 0.90 AR (0.62) ARNR3C1PGRESR1ESR2
SCHEMBL14669177 0.89 AR (0.64) ARNR3C1PGRESR1ESR2
SCHEMBL14670140 0.88 AR (0.56) ARNR3C1PGRESR1ESR2
SCHEMBL22924657 0.86 AR (0.56) ARNR3C1PGRESR1ESR2
Aglepristone SCHEMBL13625155 0.86 NR3C1 (0.72) ARNR3C1PGRESR1ESR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20130029953-A1 PROGESTERONE ANTAGONISTS EVESTRA, INC. 2013-01-31 — — 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-20130029953-A1 PROGESTERONE ANTAGONISTS PGR, PGRMC2, PGRMC1 AR 41/4885NR3C1 37/4885PGR 1/4885

“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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