SCHEMBL5624464

SCHEMBL5624464

CS(=O)(=O)N(CC(N)=O)c1ccc(NC(=C2C(=O)Nc3ccc(NS(=O)(=O)c4ccccc4)cc32)c2ccccc2)cc1

nearest known ligand 0.45

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
BRD4 O60885 12/20 0.45
BRD2 P25440 3/20 0.43
AURKA O14965 5/20 0.38
AURKB Q96GD4 5/20 0.38
KMT2A Q03164 2/20 0.38
TSHR P16473 1/20 0.38
MEN1 O00255 1/20 0.37
PDPK1 O15530 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
SCHEMBL5624454 1.00 BRD4 (0.45) BRD4BRD2AURKAAURKBKMT2A
SCHEMBL5624761 0.94 BRD4 (0.46) BRD4BRD2AURKAAURKBKMT2A
SCHEMBL5624756 0.94 BRD4 (0.46) BRD4BRD2AURKAAURKBKMT2A
SCHEMBL5428640 0.89 BRD4 (0.45) BRD4BRD2AURKAAURKBKMT2A
SCHEMBL5428644 0.89 BRD4 (0.45) BRD4BRD2AURKAAURKBKMT2A
SCHEMBL6319740 0.87 KMT2A (0.41) KMT2ATSHRMEN1
SCHEMBL6319738 0.87 KMT2A (0.41) KMT2ATSHRMEN1
SCHEMBL6750851 0.86 BRD4 (0.49) BRD4BRD2AURKAAURKBKMT2A
SCHEMBL6988928 0.86 BRD4 (0.49) BRD4BRD2AURKAAURKBKMT2A
SCHEMBL5424347 0.86 BRD4 (0.49) BRD4BRD2AURKAAURKBKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7166615-B2 Substituted indolinones, preparation thereof and their use as pharmaceutical compositions BOEHRINGER INGELHEIM PHARMA GMBH & CO. KG (DE) 2007-01-23 US disclosed
US-7160901-B2 Substituted indolinones, preparation thereof and their use as pharmaceutical compositions BOEHRINGER INGELHEIM PHARMA GMBH & CO. KG (DE) 2007-01-09 US disclosed
US-20040044053-A1 New substituted indolinones, preparation thereof and their use as pharmaceutical compositions BOEHRINGER INGELHEIM PHARMA KG (DE) 2004-03-04 US disclosed
US-20040044222-A1 New substituted indolinones, preparation thereof and their use as pharmaceutical compositions BOEHRINGER INGELHEIM PHARMA KG (DE) 2004-03-04 US disclosed
US-6638965-B2 Antitumor agents BOEHRINGER INGELHEIM PHARMA KG (DE) 2003-10-28 US disclosed
US-20030069299-A1 Substituted indolinones, preparation thereof and their use as pharmaceutical compositions BOEHRINGER INGELHEIM PHARMA GMBH & CO. KG (DE) 2003-04-10 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 (3 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-20040044053-A1 New substituted indolinones, preparation thereof and their use as pharmaceutical compositions CCNI, MKI67, CSNK1A1 BRD4 1145/4885BRD2 1996/4885AURKA 98/4885
US-20040044222-A1 New substituted indolinones, preparation thereof and their use as pharmaceutical compositions CCNI, MKI67, CSNK1A1 BRD4 1145/4885BRD2 1996/4885AURKA 98/4885
US-20030069299-A1 Substituted indolinones, preparation thereof and their use as pharmaceutical compositions CCNI, CSNK1A1, MKI67 BRD4 1082/4885BRD2 2405/4885AURKA 31/4885

“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.