SCHEMBL6464286

SCHEMBL6464286

CC(=O)c1ccc(-c2c(C)[nH]c(C)c2C(=O)O)cc1

nearest known ligand 0.50

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.50
ALDH1A1 P00352 1/20 0.50
POLB P06746 1/20 0.50
LMNA P02545 1/20 0.50
MAPT P10636 4/20 0.47
SMN1; SMN2 Q16637 3/20 0.47
BRD4 O60885 1/20 0.44
GAA P10253 2/20 0.43
MEN1 O00255 2/20 0.43
HTT P42858 1/20 0.43
HSD17B1 P14061 2/20 0.43
AR P10275 1/20 0.42
TDP1 Q9NUW8 1/20 0.39
TTR P02766 1/20 0.39
XDH P47989 1/20 0.38
MMP12 P39900 1/20 0.37
MMP13 P45452 1/20 0.37
TOP1 P11387 1/20 0.36

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
SCHEMBL7772483 0.82 LMNA (0.70) KMT2AALDH1A1POLBLMNAMAPT
SCHEMBL13280038 0.81 KMT2A (0.51) KMT2AALDH1A1POLBLMNAMAPT
SCHEMBL2024165 0.81 LMNA (0.51) KMT2AALDH1A1POLBLMNAMAPT
SCHEMBL2022798 0.79 ALDH1A1 (0.56) KMT2AALDH1A1POLBLMNAMAPT
SCHEMBL4918939 0.78 KMT2A (0.48) KMT2AALDH1A1POLBLMNAMAPT
SCHEMBL10921434 0.77 LMNA (0.68) KMT2AALDH1A1POLBLMNAMAPT
SCHEMBL10927299 0.77 KMT2A (0.68) KMT2AALDH1A1POLBLMNAMAPT
SCHEMBL6465337 0.76 KMT2A (0.72) KMT2AALDH1A1POLBLMNAMAPT
SCHEMBL6465905 0.76 ALDH1A1 (0.75) KMT2AALDH1A1POLBLMNAMAPT
SCHEMBL7825874 0.72 TTR (0.45) KMT2AALDH1A1POLBLMNASMN1; SMN2

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 KMT2A 2015/4885ALDH1A1 2144/4885POLB 3507/4885

“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.