SCHEMBL13875554

SCHEMBL13875554

Cc1ccccc1Oc1ccc(C#N)c(F)c1

nearest known ligand 0.69

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
AR P10275 18/20 0.69
POLB P06746 1/20 0.46
GAA P10253 1/20 0.46
BCAT2 O15382 1/20 0.44
BCAT1 P54687 1/20 0.44

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
SCHEMBL15268658 0.86 AR (0.75) ARPOLBGAA
SCHEMBL4168859 0.86 AR (0.54) ARPOLBGAA
SCHEMBL18615408 0.84 AR (0.52) AR
SCHEMBL4175953 0.82 AR (1.00) ARPOLBGAA
SCHEMBL4178171 0.82 AR (1.00) ARPOLBGAABCAT1
SCHEMBL4163678 0.81 AR (1.00) AR
SCHEMBL10535321 0.80 TRPV4 (0.55) AR
SCHEMBL22349698 0.79 AR (0.48) AR
SCHEMBL30689330 0.77 FFAR4 (0.46) AR
SCHEMBL15832074 0.77 POLB (0.51) ARPOLBGAA

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-20090105349-A1 ANDROGEN MODULATORS WARNER-LAMBERT COMPANY LLC (US) 2009-04-23 US disclosed
US-20090105349-A1 ANDROGEN MODULATORS WARNER-LAMBERT COMPANY LLC (US) 2009-04-23 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-20090105349-A1 ANDROGEN MODULATORS AR, NR5A1, SHBG AR 1/4885POLB 2022/4885GAA 4493/4885

“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.