SCHEMBL4199084

SCHEMBL4199084

Oc1cccc(CNc2cncc(-c3cccnc3)c2)c1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FYN P06241 1/20 0.61
EPHX2 P34913 1/20 0.51
PRMT6 Q96LA8 1/20 0.51
CLK1 P49759 4/20 0.49
DYRK1A Q13627 4/20 0.49
BACE1 P56817 1/20 0.49
SLC2A4 P14672 1/20 0.47
CYP1A2 P05177 3/20 0.46
CYP3A4 P08684 3/20 0.46
CYP2D6 P10635 2/20 0.46
CYP2C19 P33261 2/20 0.46
LTA4H P09960 1/20 0.46
HDAC4 P56524 1/20 0.45
MEF2D Q14814 1/20 0.45
HDAC1 Q13547 1/20 0.44
HIF1A Q16665 1/20 0.44
ALDH1A1 P00352 2/20 0.44
KDM4E B2RXH2 1/20 0.44
NPC1 O15118 1/20 0.44
HPGD P15428 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
SCHEMBL4187374 0.91 FYN (0.67) FYNEPHX2PRMT6CLK1DYRK1A
SCHEMBL4160677 0.91 FYN (0.73) FYNEPHX2PRMT6CLK1DYRK1A
SCHEMBL4146617 0.89 FYN (0.64) FYNSLC2A4CYP1A2CYP3A4HIF1A
SCHEMBL4155317 0.88 FYN (0.59) FYNPRMT6SLC2A4CYP1A2CYP3A4
SCHEMBL4138960 0.86 FYN (0.60) FYNCLK1DYRK1ASLC2A4CYP1A2
SCHEMBL4187608 0.86 FYN (0.60) FYNCLK1DYRK1ASLC2A4CYP1A2
SCHEMBL4180572 0.86 LTA4H (0.61) FYNEPHX2PRMT6BACE1CYP1A2
SCHEMBL4200916 0.86 LTA4H (0.57) SLC2A4CYP1A2CYP3A4LTA4HHDAC4
SCHEMBL4185311 0.86 FYN (0.63) FYNEPHX2PRMT6BACE1SLC2A4
SCHEMBL4155633 0.85 FYN (0.62) FYNCLK1DYRK1ABACE1SLC2A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090196912-A1 Pyridinylamines GPC BOTECH AG (DE) 2009-08-06 US claimed
EP-1789393-A2 PYRIDINYLAMINES GPC Biotech AG (DE) 2007-05-30 EP claimed
WO-2006010637-A2 PYRIDINYLAMINES GPC BIOTECH AG (DE) 2006-02-02 WO claimed
US-20200206188-A1 COMPOSITIONS AND METHODS TO IMPROVE THE THERAPEUTIC BENEFIT OF INDIRUBIN AND ANALOGS THEREOF, INCLUDING MEISOINDIGO BROWN DENNIS M (US) 2020-07-02 US disclosed
US-10383847-B2 Compositions and methods to improve the therapeutic benefit of indirubin and analogs thereof, including meisoindigo BROWN DENNIS M (US) 2019-08-20 US disclosed
US-20160243077-A1 COMPOSITIONS AND METHODS TO IMPROVE THE THERAPEUTIC BENEFIT OF INDIRUBIN AND ANALOGS THEREOF, INCLUDING MEISOINDIGO BROWN DENNIS M (US) 2016-08-25 US disclosed
US-20090196912-A1 Pyridinylamines GPC BOTECH AG (DE) 2009-08-06 US disclosed
EP-1789393-A2 PYRIDINYLAMINES GPC Biotech AG (DE) 2007-05-30 EP disclosed
WO-2006010637-A2 PYRIDINYLAMINES GPC BIOTECH AG (DE) 2006-02-02 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 (4 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-10383847-B2 Compositions and methods to improve the therapeutic benefit of indirubin and analogs thereof, including meisoindigo NEK9, NEK7, NEK3 FYN 3292/4885EPHX2 1066/4885PRMT6 3360/4885
US-20200206188-A1 COMPOSITIONS AND METHODS TO IMPROVE THE THERAPEUTIC BENEFIT OF INDIRUBIN AND ANALOGS THEREOF, INCLUDING MEISOINDIGO NEK9, NEK7, NEK3 FYN 3292/4885EPHX2 1066/4885PRMT6 3360/4885
US-20160243077-A1 COMPOSITIONS AND METHODS TO IMPROVE THE THERAPEUTIC BENEFIT OF INDIRUBIN AND ANALOGS THEREOF, INCLUDING MEISOINDIGO NEK9, NEK7, NEK3 FYN 3292/4885EPHX2 1066/4885PRMT6 3360/4885
US-20090196912-A1 Pyridinylamines PRNP, PLPBP, SNCA FYN 173/4885EPHX2 4091/4885PRMT6 1858/4885

“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.