SCHEMBL6466964

SCHEMBL6466964

Cc1c(C(=O)O)c(-c2ccc(C#N)cc2)c(C)n1Cc1ccc(O)cc1

nearest known ligand 0.66

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
AR P10275 13/20 0.66
FEN1 P39748 1/20 0.46
VDR P11473 1/20 0.45
PTGDR2 Q9Y5Y4 1/20 0.42
MMP3 P08254 1/20 0.42
TP53 P04637 1/20 0.41
LMNA P02545 1/20 0.41
TSHR P16473 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
ERCC5 P28715 1/20 0.41

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
SCHEMBL6465292 0.87 AR (0.82) ARLMNATSHRSMN1; SMN2
SCHEMBL24411088 0.84 AR (0.76) ARPTGDR2MMP3
SCHEMBL6465312 0.82 AR (0.89) ARPTGDR2LMNATSHRSMN1; SMN2
SCHEMBL6469732 0.81 AR (0.82) ARPTGDR2LMNASMN1; SMN2
SCHEMBL6889299 0.81 AR (0.72) ARFEN1PTGDR2LMNATSHR
SCHEMBL6468062 0.80 AR (1.00) ARPTGDR2TSHRSMN1; SMN2
SCHEMBL6468911 0.79 AR (1.00) ARLMNATSHRSMN1; SMN2
SCHEMBL6466939 0.79 AR (0.67) ARFEN1PTGDR2LMNATSHR
SCHEMBL7046828 0.78 AR (0.61) ARFEN1LMNATSHRSMN1; SMN2
SCHEMBL6468792 0.77 AR (0.80) ARTSHRSMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050101657-A1 Pyrrole derivatives for preventing or treating cancer sensitive to hormones; administered with luteininzing hormone releasing hormone derivative TAKEDA CHEMICAL INDUSTRIES LTD. (JP) 2005-05-12 US disclosed
EP-1466902-A1 ANDROGEN RECEPTOR ANTAGONISTS Takeda Chemical Industries, Ltd. (JP) 2004-10-13 EP 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-20050101657-A1 Pyrrole derivatives for preventing or treating cancer sensitive to hormones; administered with luteininzing hormone releasing hormone derivative SHBG, PRLHR, FSHR AR 6/4885FEN1 3973/4885VDR 121/4885

“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.