SCHEMBL6566693

SCHEMBL6566693

COC(=O)c1ccccc1OCc1cccc(NC(=O)Nc2ccccc2)c1

nearest known ligand 0.64

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PARP1 P09874 3/20 0.64
PPIA P62937 4/20 0.59
MEN1 O00255 4/20 0.59
KMT2A Q03164 4/20 0.59
SGMS2 Q8NHU3 1/20 0.59
ALDH1A1 P00352 3/20 0.57
SMN1; SMN2 Q16637 2/20 0.53
LMNA P02545 1/20 0.53
PARP2 Q9UGN5 2/20 0.53
KDM4E B2RXH2 1/20 0.53
NPC1 O15118 1/20 0.53
HPGD P15428 1/20 0.53
RAB9A P51151 1/20 0.53
GAA P10253 2/20 0.52
LRRK2 Q5S007 1/20 0.52
HIF1A Q16665 2/20 0.51

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
SCHEMBL6566692 0.86 MEN1 (0.61) PPIAMEN1KMT2ASGMS2ALDH1A1
SCHEMBL30802658 0.86 PARP1 (0.83) PARP1PPIAMEN1KMT2ASGMS2
SCHEMBL29200349 0.86 PARP1 (0.83) PARP1PPIAMEN1KMT2ASGMS2
SCHEMBL6564693 0.85 LRRK2 (0.57) PARP1PPIAMEN1KMT2AALDH1A1
SCHEMBL6566043 0.84 LRRK2 (0.56) PARP1PPIAMEN1KMT2ASGMS2
SCHEMBL6568084 0.84 PPIA (0.60) PARP1PPIAMEN1KMT2ASGMS2
SCHEMBL978857 0.83 HTT (0.64) MEN1KMT2ASGMS2ALDH1A1SMN1; SMN2
SCHEMBL6566105 0.82 PPIA (0.58) PPIAMEN1KMT2ASMN1; SMN2LMNA
SCHEMBL6567940 0.82 PPIA (0.58) PARP1PPIAMEN1KMT2ASGMS2
SCHEMBL6565756 0.81 MEN1 (0.56) PPIAMEN1KMT2ASGMS2SMN1; 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-20040259912-A1 Benzine derivatives, process for preparing the same and use thereof TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2004-12-23 US disclosed
EP-1437344-A1 BENZENE DERIVATIVES,PROCESS FOR PREPARING THE SAME AND USE THEREOF Takeda Chemical Industries, Ltd. (JP) 2004-07-14 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-20040259912-A1 Benzine derivatives, process for preparing the same and use thereof HRH4, HRH2, HRH1 PARP1 3260/4885PPIA 4339/4885MEN1 4143/4885

“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.