SCHEMBL5828735

SCHEMBL5828735

CN1C(=O)C(Br)=C(c2c[nH]c3ncccc23)C1=O

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PIM1 P11309 2/20 0.54
TGFBR1 P36897 4/20 0.49
IKBKE Q14164 3/20 0.49
PDPK1 O15530 3/20 0.49
TBK1 Q9UHD2 3/20 0.49
SIRT2 Q8IXJ6 1/20 0.49
SIRT1 Q96EB6 1/20 0.49
AXL P30530 1/20 0.48
CAMKK2 Q96RR4 2/20 0.47
KDR P35968 1/20 0.46
FLT3 P36888 1/20 0.46
DYRK1A Q13627 1/20 0.43
RPS6KA5 O75582 1/20 0.43
CDK2 P24941 4/20 0.43
CCNT1 O60563 2/20 0.43
CCNA2 P20248 2/20 0.43
CDK9 P50750 2/20 0.43
CCNE1 P24864 1/20 0.43
PRKCQ Q04759 1/20 0.43
BRD4 O60885 1/20 0.42

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
Tert-Butyl Formate SCHEMBL27610429 0.89 PIM1 (0.45) PIM1TGFBR1IKBKEPDPK1TBK1
SCHEMBL13204318 0.84 PIM1 (0.54) PIM1TGFBR1IKBKEPDPK1TBK1
SCHEMBL3050825 0.78 SIRT2 (0.56) PIM1SIRT2AXLCAMKK2KDR
SCHEMBL15799855 0.78 CAMKK2 (0.56) PIM1TGFBR1IKBKEPDPK1TBK1
SCHEMBL5343477 0.78 SIRT2 (0.80) PIM1SIRT2SIRT1KDRFLT3
SCHEMBL6081255 0.77 PIM1 (0.47) PIM1TGFBR1IKBKEPDPK1TBK1
SCHEMBL5879226 0.77 FLT3 (0.57) PIM1TGFBR1IKBKEPDPK1TBK1
SCHEMBL17210880 0.76 PIM1 (0.50) PIM1TGFBR1IKBKEPDPK1TBK1
SCHEMBL5828027 0.75 PIM1 (0.47) PIM1SIRT2AXLCAMKK2KDR
SCHEMBL6575546 0.75 PIM1 (0.53) PIM1TGFBR1IKBKEPDPK1TBK1

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 25 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2928465-B1 USE OF MALEIMIDE DERIVATIVES FOR PREVENTING AND TREATING CANCER CENTOGENE GMBH (DE) 2020-11-18 EP disclosed
EP-2928465-B1 USE OF MALEIMIDE DERIVATIVES FOR PREVENTING AND TREATING CANCER CENTOGENE GMBH (DE) 2020-11-18 EP disclosed
EP-2928466-B1 USE OF MALEIMIDE DERIVATIVES FOR PREVENTING AND TREATING LEUKEMIA CENTOGENE GMBH (DE) 2020-10-28 EP disclosed
EP-2928466-B1 USE OF MALEIMIDE DERIVATIVES FOR PREVENTING AND TREATING LEUKEMIA CENTOGENE GMBH (DE) 2020-10-28 EP disclosed
US-10420754-B2 Use of maleimide derivatives for preventing and treating cancer CENTOGENE AG (DE) 2019-09-24 US disclosed
US-20180325877-A1 Use of Maleimide Derivatives for Preventing and Treating Cancer CENTOGENE GMBH (DE) 2018-11-15 US disclosed
US-9993463-B2 Use of maleimide derivatives for preventing and treating cancer CENTOGENE AG (DE) 2018-06-12 US disclosed
US-9724331-B2 Use of maleimide derivatives for preventing and treating leukemia CENTOGENE AG (DE) 2017-08-08 US disclosed
US-20150313882-A1 USE OF MALEIMIDE DERIVATIVES FOR PREVENTING AND TREATING CANCER CENTOGENE AG (DE) 2015-11-05 US disclosed
US-20150306070-A1 USE OF MALEIMIDE DERIVATIVES FOR PREVENTING AND TREATING LEUKEMIA CENTOGENE AG (DE) 2015-10-29 US disclosed
WO-2014090396-A2 USE OF MALEIMIDE DERIVATIVES FOR PREVENTING AND TREATING CANCER CENTOGENE AG (DE) 2014-06-19 WO disclosed
US-7151108-B2 Anticarcinogenic, antiproliferative, and antitumor agents LES LABORATORIES SERVIER (FR) 2006-12-19 US disclosed
US-7001906-B2 Pyrido-pyrido-pyrrolo pyrrolo-indole and pyrido-pyrrolo pyrrolo carbazole derivatives, method for the production thereof and pharmaceutical compositions containing said derivatives LES LABORATOIRES SERVIER (FR) 2006-02-21 US disclosed
US-20060004428-A1 Pyrrolo (3,4-c) carbazole and pyrido (2,3-b) pyrrolo (3,4-e) indole derivatives, preparation method and pharmaceutical compositions containing same LES LABORATOIRES SERVIER (FR) 2006-01-05 US disclosed
EP-1411057-B1 [3,4-a:3,4-c]carbazole derivatives, process for their preparation and pharmaceutical compositions containing them SERVIER LAB (FR) 2005-04-27 EP disclosed
US-20040152721-A1 Pyrido-pyrido-pyrrolo pyrrolo-indole and pyrido-pyrrolo pyrrolo carbazole derivatives, method for the production thereof and pharmaceutical compositions containing said derivatives LES LABORATOIRES SERVIER (FR) 2004-08-05 US disclosed
US-20040077672-A1 Anticarcinogenic, antiproliferative, and antitumor agents LES LABORATOIRES SERVIER (FR) 2004-04-22 US disclosed
EP-1411057-A1 [3,4-a:3,4-c]carbazole derivatives, process for their preparation and pharmaceutical compositions containing them Les Laboratoires Servier (FR) 2004-04-21 EP disclosed
EP-1409486-A1 PYRIDO-PYRIDO-PYRROLO PYRROLO-INDOLE AND PYRIDO-PYRROLO PYRROLO CARBAZOLE DERIVATIVES, METHOD FOR THE PRODUCTION THEREOF AND PHARMACEUTICAL COMPOSITIONS CONTAINING SAID DERIVATIVES LES LABORATOIRES SERVIER (FR) 2004-04-21 EP disclosed
WO-2003002563-A1 PYRIDO-PYRIDO-PYRROLO PYRROLO-INDOLE AND PYRIDO-PYRROLO PYRROLO CARBAZOLE DERIVATIVES, METHOD FOR THE PRODUCTION THEREOF AND PHARMACEUTICAL COMPOSITIONS CONTAINING SAID DERIVATIVES LES LABORATOIRES SERVIER (FR) 2003-01-09 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 (6 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-20150313882-A1 USE OF MALEIMIDE DERIVATIVES FOR PREVENTING AND TREATING CANCER MGMT, CBR3, IDH3A PIM1 3826/4885TGFBR1 2161/4885IKBKE 1806/4885
US-20180325877-A1 Use of Maleimide Derivatives for Preventing and Treating Cancer MGMT, IDH3A, CYP3A43 PIM1 3743/4885TGFBR1 2075/4885IKBKE 1609/4885
US-20040152721-A1 Pyrido-pyrido-pyrrolo pyrrolo-indole and pyrido-pyrrolo pyrrolo carbazole derivatives, method for the production thereof and pharmaceutical compositions containing said derivatives PYM1, PNPO, IDO1 PIM1 1680/4885TGFBR1 2488/4885IKBKE 2665/4885
US-20150306070-A1 USE OF MALEIMIDE DERIVATIVES FOR PREVENTING AND TREATING LEUKEMIA MCL1, NPM1, FLI1 PIM1 2347/4885TGFBR1 3330/4885IKBKE 802/4885
US-20040077672-A1 Anticarcinogenic, antiproliferative, and antitumor agents XDH, TOP2A, TOP1 PIM1 4162/4885TGFBR1 958/4885IKBKE 1645/4885
US-10420754-B2 Use of maleimide derivatives for preventing and treating cancer MGMT, IDH3A, CYP3A43 PIM1 3743/4885TGFBR1 2075/4885IKBKE 1609/4885

“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.