SCHEMBL6907265

SCHEMBL6907265

COC(=O)c1ccc(-c2ccc3cc4c(cc3c2)C(c2cccc(C)c2)=CCC4(C)C)cc1

nearest known ligand 0.64

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
RARB P10826 14/20 0.64
RARG P13631 13/20 0.64
RARA P10276 13/20 0.64
PGR P06401 1/20 0.42
PLAU P00749 1/20 0.41
RXRA P19793 1/20 0.40
NR2E1 Q9Y466 1/20 0.40
EGFR P00533 1/20 0.40
CYP19A1 P11511 1/20 0.40
CYP11B1 P15538 1/20 0.40
CYP11B2 P19099 1/20 0.40
MAPK14 Q16539 1/20 0.39

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
SCHEMBL8437231 0.86 RARB (0.66) RARBRARGRARAPLAURXRA
SCHEMBL8709650 0.85 CYP11B2 (0.58) RARBRARGRARARXRANR2E1
SCHEMBL8709424 0.83 RARB (0.63) RARBRARGRARARXRANR2E1
SCHEMBL6548975 0.83 RARA (0.43) RARBRARGRARAPGRPLAU
SCHEMBL8438952 0.82 RARB (0.56) RARBRARGRARAPLAURXRA
SCHEMBL8706490 0.79 RARB (0.85) RARBRARGRARARXRANR2E1
SCHEMBL8706311 0.79 RARB (1.00) RARBRARGRARARXRANR2E1
SCHEMBL8709506 0.77 RARB (0.80) RARBRARGRARARXRANR2E1
SCHEMBL8705923 0.77 RARA (0.51) RARBRARGRARAPGRPLAU
SCHEMBL8705921 0.76 RARA (0.48) RARBRARGRARAPLAUEGFR

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-20040122080-A1 Synergist combinations of retinoid receptor ligands and selected cytotoxic agents for treatment of cancer BRISTOL-MYERS SQUIBB COMPANY 2004-06-24 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-20040122080-A1 Synergist combinations of retinoid receptor ligands and selected cytotoxic agents for treatment of cancer RARA, RARG, RARB RARB 3/4885RARG 2/4885RARA 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.