SCHEMBL6466987

SCHEMBL6466987

Cc1c(C#N)c(-c2ccc(C#N)cc2)c(C)n1Cc1cn(C)cn1

nearest known ligand 0.58

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
AR P10275 10/20 0.58
EGLN2 Q96KS0 1/20 0.39
CYP11B2 P19099 2/20 0.37
NSD2 O96028 2/20 0.36
FNTA P49354 2/20 0.36
FNTB P49356 2/20 0.36
GRIA2 P42262 1/20 0.36
GRIA4 P48058 1/20 0.36
CSF1R P07333 1/20 0.35
BRD4 O60885 1/20 0.35

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
SCHEMBL6466733 0.81 AR (0.60) ARCYP11B2NSD2GRIA2GRIA4
SCHEMBL6466386 0.80 AR (0.58) ARFNTAFNTBGRIA2GRIA4
SCHEMBL5366353 0.79 AR (0.60) ARCYP11B2GRIA2GRIA4
SCHEMBL6466150 0.79 AR (0.69) ARCYP11B2
SCHEMBL6468311 0.78 AR (0.61) AREGLN2CYP11B2
SCHEMBL5362024 0.78 AR (0.58) ARCYP11B2FNTAFNTBGRIA2
SCHEMBL5362232 0.78 AR (0.61) ARCYP11B2FNTAFNTBGRIA2
SCHEMBL6468889 0.77 AR (0.86) ARCYP11B2
SCHEMBL6466490 0.77 AR (0.58) ARCYP11B2GRIA2GRIA4
SCHEMBL5362087 0.77 AR (0.60) ARCYP11B2GRIA2GRIA4

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 6/4885EGLN2 601/4885CYP11B2 151/4885

“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.