SCHEMBL1961864

SCHEMBL1961864

CCOC(=O)c1cccc(Nc2ccc3ccccc3c2)c1C(=O)O

nearest known ligand 0.53

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CDC25B P30305 9/20 0.53
CDC25A P30304 2/20 0.53
CDC25C P30307 2/20 0.53
DHODH Q02127 3/20 0.52
TSHR P16473 3/20 0.48
MAPK10 P53779 1/20 0.48
ATM Q13315 1/20 0.46
BRAF P15056 1/20 0.45
KMT2A Q03164 1/20 0.44
LMNA P02545 1/20 0.44
TP53 P04637 1/20 0.44
HPGD P15428 1/20 0.44
RAB9A P51151 1/20 0.44

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
SCHEMBL1963500 0.86 ATM (0.55) CDC25BCDC25ACDC25CTSHRMAPK10
SCHEMBL1961347 0.84 AKR1C3 (0.57) CDC25BCDC25ACDC25CTSHRKMT2A
SCHEMBL1962364 0.84 POLB (0.53) TSHRMAPK10KMT2ALMNATP53
SCHEMBL1964221 0.83 ALDH1A1 (0.53) CDC25BCDC25ACDC25CDHODHKMT2A
SCHEMBL1961719 0.83 CTSV (0.55) CDC25BCDC25ACDC25CKMT2ALMNA
SCHEMBL1962162 0.82 CDC25B (0.46) CDC25BCDC25ACDC25CTSHRATM
SCHEMBL1963131 0.81 DHODH (0.52) CDC25BCDC25ACDC25CDHODHATM
SCHEMBL1961862 0.80 MAPT (0.52) MAPK10ATMKMT2ARAB9A
SCHEMBL1964589 0.80 CTSV (0.52) CDC25BCDC25ACDC25CKMT2ALMNA
SCHEMBL1964167 0.80 DHODH (0.48) CDC25BCDC25ACDC25CDHODHTSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1919892-B1 ISOINDOLE-IMIDE COMPOUNDS AND COMPOSITIONS COMPRISING AND METHODS OF USING THE SAME CELGENE CORP (US) 2013-08-14 EP disclosed
US-8481568-B2 Isoindole-imide compounds and compositions comprising and methods of using the same CELGENE CORPORATION (US) 2013-07-09 US disclosed
US-20110144158-A1 ISOINDOLE-IMIDE COMPOUNDS AND COMPOSITIONS COMPRISING AND METHODS OF USING THE SAME SEPRACOR INC. 2011-06-16 US disclosed
US-20070049618-A1 Isoindole-imide compounds and compositions comprising and methods of using the same CELGENE CORPORATION 2007-03-01 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 (2 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-20110144158-A1 ISOINDOLE-IMIDE COMPOUNDS AND COMPOSITIONS COMPRISING AND METHODS OF USING THE SAME SI, CYP3A5, CYP2D6 CDC25B 420/4885CDC25A 618/4885CDC25C 223/4885
US-20070049618-A1 Isoindole-imide compounds and compositions comprising and methods of using the same SI, CYP3A5, CYP2D6 CDC25B 420/4885CDC25A 618/4885CDC25C 223/4885

“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.