SCHEMBL4789593

SCHEMBL4789593

NC(=O)c1c[nH]c2c1CCCC2

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 5/20 0.47
ALOX15 P16050 4/20 0.47
MAPK1 P28482 3/20 0.47
CASP1 P29466 1/20 0.47
CASP7 P55210 1/20 0.47
ALDH1A1 P00352 6/20 0.45
KMT2A Q03164 4/20 0.45
MAPT P10636 4/20 0.45
MEN1 O00255 3/20 0.45
USP2 O75604 2/20 0.45
IKBKB O14920 1/20 0.45
TP53 P04637 1/20 0.45
MAPK10 P53779 1/20 0.45
ATM Q13315 1/20 0.42
NNMT P40261 2/20 0.35
GFER P55789 1/20 0.35
HCAR2 Q8TDS4 1/20 0.34
PIM1 P11309 1/20 0.34
PIM3 Q86V86 1/20 0.34
KDM4E B2RXH2 4/20 0.33

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
SCHEMBL26110395 0.96 HSD17B10 (0.44) HSD17B10ALOX15MAPK1CASP1CASP7
SCHEMBL22289913 0.82 GFER (0.46) HSD17B10ALOX15MAPK1CASP1CASP7
SCHEMBL7532325 0.78 HCAR2 (0.36) HSD17B10ALOX15MAPK1CASP1CASP7
SCHEMBL19140344 0.77 USP2 (0.45) HSD17B10ALDH1A1KMT2AMAPTUSP2
SCHEMBL2114253 0.74 KDM4E (0.45) HSD17B10ALDH1A1KMT2AMAPTMEN1
SCHEMBL23937644 0.73 ALDH1A1 (0.40) HSD17B10ALOX15CASP1CASP7ALDH1A1
SCHEMBL7394232 0.73 ALDH1A1 (0.39) HSD17B10ALOX15MAPK1CASP1CASP7
SCHEMBL22289985 0.73 MAPT (0.54) HSD17B10ALOX15MAPK1ALDH1A1KMT2A
SCHEMBL22289963 0.73 CXCR2 (0.36) HSD17B10ALOX15MAPK1CASP1CASP7
SCHEMBL7435029 0.73 BTK (0.34) HSD17B10ALOX15MAPK1CASP1CASP7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2827869-A2 COMPOSITIONS AND METHODS TO IMPROVE THE THERAPEUTIC BENEFIT OF INDIRUBIN AND ANALOGS THEREOF, INCLUDING MEISOINDIGO Brown, Dennis (US) 2015-01-28 EP claimed
WO-2013142817-A2 COMPOSITIONS AND METHODS TO IMPROVE THE THERAPEUTIC BENEFIT OF INDIRUBIN AND ANALOGS THEREOF, INCLUDING MEISOINDIGO BROWN DENNIS (US) 2013-09-26 WO claimed
WO-2008148034-A1 MAPK/ERK KINASE INHIBITORS TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2008-12-04 WO claimed
EP-1210328-A1 FUSED PYRROLECARBOXAMIDES: A NEW CLASS OF GABA BRAIN RECEPTOR LIGANDS NEUROGEN CORPORATION (US) 2002-06-05 EP claimed
WO-2001016103-A1 FUSED PYRROLECARBOXAMIDES: GABA BRAIN RECEPTOR LIGANDS NEUROGEN CORPORATION (US) 2001-03-08 WO claimed
CN-115969814-A Novel pharmaceutical formulations containing indirubin and derivatives thereof and methods of making and using the same 法斯瑞斯公司 2023-04-18 CN disclosed
US-20230100193-A1 NOVEL PHARMACEUTICAL FORMULATIONS CONTAINING INDIRUBIN AND DERIVATIVES THEREOF AND METHODS OF MAKING AND USING THE SAME CYTODIGM, INC. 2023-03-30 US disclosed
EP-3600259-A1 NOVEL PHARMACEUTICAL FORMULATIONS CONTAINING INDIRUBIN AND DERIVATIVES THEREOF AND METHODS OF MAKING AND USING THE SAME Phosphorex, Inc. (US) 2020-02-05 EP disclosed
WO-2018183631-A1 NOVEL PHARMACEUTICAL FORMULATIONS CONTAINING INDIRUBIN AND DERIVATIVES THEREOF AND METHODS OF MAKING AND USING THE SAME PHOSPHOREX, INC. (US) 2018-10-04 WO disclosed
EP-2827869-A2 COMPOSITIONS AND METHODS TO IMPROVE THE THERAPEUTIC BENEFIT OF INDIRUBIN AND ANALOGS THEREOF, INCLUDING MEISOINDIGO Brown, Dennis (US) 2015-01-28 EP disclosed
WO-2013142817-A2 COMPOSITIONS AND METHODS TO IMPROVE THE THERAPEUTIC BENEFIT OF INDIRUBIN AND ANALOGS THEREOF, INCLUDING MEISOINDIGO BROWN DENNIS (US) 2013-09-26 WO disclosed
WO-2008148034-A1 MAPK/ERK KINASE INHIBITORS TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2008-12-04 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 (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-20230100193-A1 NOVEL PHARMACEUTICAL FORMULATIONS CONTAINING INDIRUBIN AND DERIVATIVES THEREOF AND METHODS OF MAKING AND USING THE SAME UGT2B7, UGT1A7, CYP3A7 HSD17B10 265/4885ALOX15 440/4885MAPK1 4412/4885

“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.