SCHEMBL6122016

SCHEMBL6122016

COC(=O)C(Cc1ccc(Br)cc1OC)C(C)=O

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PYCR1 P32322 1/20 0.43
ALDH1A1 P00352 4/20 0.41
KDM4E B2RXH2 3/20 0.41
TDP1 Q9NUW8 2/20 0.41
MEN1 O00255 2/20 0.40
KMT2A Q03164 2/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
LPAR1 Q92633 1/20 0.38
LMNA P02545 1/20 0.38
RXFP1 Q9HBX9 1/20 0.38
GAA P10253 2/20 0.37
USP2 O75604 1/20 0.37
MAPT P10636 1/20 0.37
THRB P10828 1/20 0.37
ALOX15 P16050 1/20 0.37
CASP1 P29466 1/20 0.37
HTT P42858 1/20 0.37
RECQL P46063 1/20 0.37
BLM P54132 1/20 0.37
HSD17B10 Q99714 1/20 0.37

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
SCHEMBL6120000 0.89 ALDH1A1 (0.43) PYCR1ALDH1A1KDM4ETDP1MEN1
SCHEMBL15305553 0.84 EPHX1 (0.44) ALDH1A1MEN1KMT2ASMN1; SMN2LPAR1
SCHEMBL15305570 0.84 PYCR1 (0.38) PYCR1ALDH1A1KDM4EMEN1KMT2A
SCHEMBL15390848 0.82 CA12 (0.50) ALDH1A1KDM4ESMN1; SMN2LMNAGAA
SCHEMBL16616707 0.82 MAPT (0.48) ALDH1A1KDM4EMEN1KMT2ASMN1; SMN2
SCHEMBL24981985 0.82 ALDH1A1 (0.47) PYCR1ALDH1A1KDM4ETDP1MEN1
SCHEMBL28989317 0.82 ALDH1A1 (0.47) PYCR1ALDH1A1KDM4ETDP1MEN1
SCHEMBL31295843 0.80 ACACB (0.39) ALDH1A1MEN1KMT2AGAAUSP2
SCHEMBL27942554 0.80 MTNR1A (0.51) ALDH1A1MEN1KMT2AGAAHTT
SCHEMBL30036398 0.78 ALDH1A1 (0.49) ALDH1A1KDM4ETDP1MEN1KMT2A

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20130267532-A1 CYCLIC AMIDE COMPOUNDS AND THEIR USE IN THE TREATMENT OF DISEASE SUMITOMO DAINIPPON PHARMA CO., LTD. (JP) 2013-10-10 US disclosed
US-20130267532-A1 CYCLIC AMIDE COMPOUNDS AND THEIR USE IN THE TREATMENT OF DISEASE SUMITOMO DAINIPPON PHARMA CO., LTD. (JP) 2013-10-10 US disclosed
EP-2640716-A1 CYCLIC AMIDE COMPOUNDS AND THEIR USE IN THE TREATMENT OF DISEASE Dainippon Sumitomo Pharma Co., Ltd. (JP) 2013-09-25 EP disclosed
WO-2012067268-A1 CYCLIC AMIDE COMPOUNDS AND THEIR USE IN THE TREATMENT OF DISEASE DAINIPPON SUMITOMO PHARMA CO., LTD. (JP) 2012-05-24 WO disclosed
WO-2012067268-A1 CYCLIC AMIDE COMPOUNDS AND THEIR USE IN THE TREATMENT OF DISEASE DAINIPPON SUMITOMO PHARMA CO., LTD. (JP) 2012-05-24 WO 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-20130267532-A1 CYCLIC AMIDE COMPOUNDS AND THEIR USE IN THE TREATMENT OF DISEASE CCNI, CCNT1, CCNT2 PYCR1 170/4885ALDH1A1 403/4885KDM4E 3301/4885

“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.