SCHEMBL6466685

SCHEMBL6466685

COC(=O)c1c(-c2ccc(Cl)c(Cl)c2)c(C)n(Cc2cccnc2)c1C

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AR P10275 6/20 0.59
P2RX7 Q99572 1/20 0.47
ALDH1A1 P00352 2/20 0.45
MAPT P10636 2/20 0.45
GAA P10253 1/20 0.45
PKM P14618 1/20 0.45
HSP90AA1 P07900 1/20 0.45
HSP90B1 P14625 1/20 0.45
TSHR P16473 1/20 0.44
MAPK1 P28482 1/20 0.44
MEN1 O00255 1/20 0.43
LMNA P02545 1/20 0.43
HTT P42858 1/20 0.43
KMT2A Q03164 1/20 0.43
RAB9A P51151 1/20 0.41
PTGDR2 Q9Y5Y4 1/20 0.41
KDM4E B2RXH2 1/20 0.41
POLB P06746 1/20 0.41
NOX4 Q9NPH5 1/20 0.41
OPRK1 P41145 1/20 0.40

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
SCHEMBL6469535 0.88 AR (0.76) ARALDH1A1MAPTGAAPKM
SCHEMBL6464888 0.82 AR (0.77) ARTSHRMAPK1PTGDR2KDM4E
SCHEMBL6469782 0.80 AR (0.74) ARALDH1A1MAPTGAAPKM
SCHEMBL6469624 0.79 AR (0.81) ARTSHRMAPK1
SCHEMBL6465913 0.77 AR (0.76) ARALDH1A1MAPTGAAPKM
SCHEMBL6469603 0.76 AR (0.81) ARALDH1A1MAPTGAAPKM
SCHEMBL24501499 0.75 MEN1 (0.50) ARP2RX7ALDH1A1MAPTMEN1
SCHEMBL30504577 0.75 MEN1 (0.50) ARP2RX7ALDH1A1MAPTMEN1
SCHEMBL6466975 0.75 AR (0.49) ARALDH1A1MAPTLMNAPTGDR2
SCHEMBL6469303 0.73 AR (0.67) ARMAPTTSHR

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 6/4885P2RX7 4114/4885ALDH1A1 2144/4885

“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.