SCHEMBL6840796

SCHEMBL6840796

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nearest known ligand 0.75

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ AR P10275 10/20 0.50
▸ PGR P06401 8/20 0.50
▸ NR3C2 P08235 3/20 0.50
▸ SHBG P04278 5/20 0.48
▸ ALDH1A1 P00352 2/20 0.41
▸ ESR1 P03372 1/20 0.39
▸ ESR2 Q92731 1/20 0.39
▸ NR3C1 P04150 1/20 0.38
▸ ADRA1A P35348 1/20 0.38
▸ HTR2B P41595 1/20 0.38
▸ LMNA P02545 1/20 0.37
▸ MAPT P10636 1/20 0.37
▸ STS P08842 1/20 0.37

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
SCHEMBL5974319 1.00 AR (0.50) ARPGRNR3C2SHBGALDH1A1
SCHEMBL5974247 0.86 ESR1 (0.49) ARPGRNR3C2SHBGALDH1A1
SCHEMBL6838182 0.86 AR (0.49) ARPGRNR3C2SHBGALDH1A1
Mibolerone SCHEMBL14275154 0.86 AR (0.67) ARPGRNR3C2SHBGALDH1A1
Mibolerone SCHEMBL4362587 0.86 AR (0.67) ARPGRNR3C2SHBGALDH1A1
Mibolerone SCHEMBL565277 0.86 AR (0.67) ARPGRNR3C2SHBGALDH1A1
Mibolerone SCHEMBL10603681 0.86 AR (0.67) ARPGRNR3C2SHBGALDH1A1
SCHEMBL24476271 0.85 PGR (0.54) ARPGRNR3C2SHBGALDH1A1
SCHEMBL5974963 0.85 PGR (0.54) ARPGRNR3C2SHBGALDH1A1
SCHEMBL23822244 0.85 PGR (0.54) ARPGRNR3C2SHBGALDH1A1

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-20040043972-A1 3-Methylene steroid derivatives AKZO NOBEL N.V. (NL) 2004-03-04 — — 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-20040043972-A1 3-Methylene steroid derivatives HSD17B11, NR5A1, CYP17A1 AR 29/4885PGR 26/4885NR3C2 10/4885

“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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