SCHEMBL4568382

SCHEMBL4568382

COc1cc(CC(=O)c2ccoc2)c(NC(=O)OC(C)(C)C)cc1Cl

nearest known ligand 0.39

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 5/20 0.38
MAPT P10636 5/20 0.38
KMT2A Q03164 5/20 0.38
ALDH1A1 P00352 4/20 0.38
SMN1; SMN2 Q16637 2/20 0.38
KDM4E B2RXH2 4/20 0.38
LMNA P02545 3/20 0.37
GAA P10253 1/20 0.36
SUV39H2 Q9H5I1 2/20 0.36
NPSR1 Q6W5P4 2/20 0.36
TSHR P16473 1/20 0.36
L3MBTL1 Q9Y468 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
SCHEMBL9103819 0.86 LMNA (0.42) MEN1MAPTKMT2AALDH1A1SMN1; SMN2
SCHEMBL8761782 0.82 ALDH1A1 (0.37) MEN1MAPTKMT2AALDH1A1KDM4E
SCHEMBL4568055 0.82 KMT2A (0.37) MEN1MAPTKMT2AALDH1A1SMN1; SMN2
SCHEMBL4568367 0.81 MEN1 (0.43) MEN1MAPTKMT2AALDH1A1SMN1; SMN2
SCHEMBL4568378 0.75 ALDH1A1 (0.44) MEN1MAPTKMT2AALDH1A1SMN1; SMN2
SCHEMBL4568383 0.74 ALDH1A1 (0.44) MEN1MAPTKMT2AALDH1A1SMN1; SMN2
SCHEMBL4568376 0.74 MEN1 (0.43) MEN1MAPTKMT2AALDH1A1SMN1; SMN2
SCHEMBL8761774 0.73 KMT2A (0.42) MEN1MAPTKMT2ASMN1; SMN2L3MBTL1
SCHEMBL4568379 0.72 ALDH1A1 (0.45) MEN1MAPTKMT2AALDH1A1SMN1; SMN2
SCHEMBL2792741 0.72 ALDH1A1 (0.46) MEN1MAPTKMT2AALDH1A1SMN1; 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-20120122931-A1 INDOLE DERIVATIVE OR PHARMACEUTICALLY ACCEPTABLE SALT THEREOF KISSEI PHARMACEUTICAL CO., LTD. (JP) 2012-05-17 US disclosed
US-20120122931-A1 INDOLE DERIVATIVE OR PHARMACEUTICALLY ACCEPTABLE SALT THEREOF KISSEI PHARMACEUTICAL CO., LTD. (JP) 2012-05-17 US 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-20120122931-A1 INDOLE DERIVATIVE OR PHARMACEUTICALLY ACCEPTABLE SALT THEREOF PTGER1, CYSLTR1, LTB4R MEN1 2993/4885MAPT 3199/4885KMT2A 2056/4885

“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.