SCHEMBL6466466

SCHEMBL6466466

CCOC(=O)c1c(-c2cccc(C#N)c2)c(C)n(Cc2ccc(F)cc2F)c1C

nearest known ligand 0.46

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
KCNK3 O14649 10/20 0.46
AR P10275 3/20 0.45
FNTA P49354 1/20 0.44
FNTB P49356 1/20 0.44
CNR2 P34972 1/20 0.43
MAPK14 Q16539 1/20 0.42
MAPT P10636 2/20 0.42
LMNA P02545 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
VNN1 O95497 1/20 0.41
KDM4E B2RXH2 1/20 0.41
PKM P14618 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
SCHEMBL6466738 0.79 MAPT (0.47) ARFNTAFNTBCNR2MAPT
SCHEMBL6467848 0.78 AR (0.66) ARMAPT
SCHEMBL6466989 0.77 AR (0.67) ARMAPTLMNAKDM4E
SCHEMBL6882430 0.74 AR (0.75) ARCNR2MAPTLMNASMN1; SMN2
SCHEMBL6466411 0.74 AR (0.78) ARMAPTLMNASMN1; SMN2KDM4E
SCHEMBL6466975 0.73 AR (0.49) ARMAPTLMNASMN1; SMN2
SCHEMBL7046828 0.71 AR (0.61) ARLMNASMN1; SMN2
SCHEMBL6469678 0.70 PTGDR2 (0.41) ARMAPTSMN1; SMN2
SCHEMBL6469514 0.70 AR (0.55) ARMAPK14MAPTLMNAKDM4E
SCHEMBL15998944 0.69 TSHR (0.60) MAPK14MAPTLMNASMN1; SMN2KDM4E

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 KCNK3 3824/4885AR 6/4885FNTA 3791/4885

“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.