SCHEMBL6468908

SCHEMBL6468908

COC(=O)c1c(C)[nH]c(C)c1-c1ccc(-c2ccccc2)cc1

nearest known ligand 0.94

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.94
ALDH1A1 P00352 6/20 0.77
KMT2A Q03164 3/20 0.77
POLB P06746 1/20 0.77
RAB9A P51151 2/20 0.69
HTT P42858 4/20 0.66
GAA P10253 4/20 0.66
SMN1; SMN2 Q16637 4/20 0.66
MAPT P10636 4/20 0.66
MEN1 O00255 2/20 0.66
TSHR P16473 2/20 0.61
NR4A2 P43354 1/20 0.53
AR P10275 2/20 0.49
NPSR1 Q6W5P4 3/20 0.48
CYP1A2 P05177 1/20 0.48
CYP3A4 P08684 1/20 0.48
CYP2D6 P10635 1/20 0.48
CYP2C9 P11712 1/20 0.48
NFKB1 P19838 1/20 0.48
CYP2C19 P33261 1/20 0.48

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
SCHEMBL6465905 0.86 ALDH1A1 (0.75) LMNAALDH1A1KMT2APOLBRAB9A
SCHEMBL6464519 0.86 ALDH1A1 (0.79) LMNAALDH1A1KMT2APOLBRAB9A
SCHEMBL6469579 0.86 ALDH1A1 (0.79) LMNAALDH1A1KMT2APOLBRAB9A
SCHEMBL6469553 0.84 KMT2A (0.77) LMNAALDH1A1KMT2APOLBRAB9A
SCHEMBL6466951 0.83 ALDH1A1 (0.75) LMNAALDH1A1KMT2APOLBRAB9A
SCHEMBL6469625 0.82 LMNA (0.69) LMNAALDH1A1KMT2APOLBRAB9A
SCHEMBL6466860 0.82 ALDH1A1 (0.73) LMNAALDH1A1KMT2APOLBRAB9A
SCHEMBL6466338 0.82 ALDH1A1 (0.73) LMNAALDH1A1KMT2APOLBRAB9A
SCHEMBL6469771 0.82 ALDH1A1 (0.73) LMNAALDH1A1KMT2APOLBRAB9A
SCHEMBL6465316 0.82 ALDH1A1 (0.73) LMNAALDH1A1KMT2APOLBRAB9A

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 LMNA 4715/4885ALDH1A1 2144/4885KMT2A 2015/4885

“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.