SCHEMBL214646

SCHEMBL214646

NC(=O)c1c(C(=O)Nc2ccccc2Cl)ncn1-c1nc2ccccc2[nH]1

nearest known ligand 0.44

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
EPHB3 P54753 2/20 0.44
LMNA P02545 3/20 0.43
CACNA1G O43497 1/20 0.43
MAPT P10636 5/20 0.40
KDM4E B2RXH2 1/20 0.40
SIRT1 Q96EB6 1/20 0.39
MEN1 O00255 4/20 0.39
KMT2A Q03164 4/20 0.39
ALDH1A1 P00352 2/20 0.39
HTT P42858 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
STK33 Q9BYT3 3/20 0.39
POLB P06746 1/20 0.39
CYP3A4 P08684 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
TSHR P16473 1/20 0.38

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
SCHEMBL214450 0.92 LMNA (0.54) LMNAMAPTKDM4EMEN1KMT2A
SCHEMBL215203 0.91 STK33 (0.40) LMNAMAPTMEN1KMT2AALDH1A1
SCHEMBL214976 0.90 LCK (0.44) LMNAMAPTKDM4EMEN1KMT2A
SCHEMBL214714 0.88 MAPT (0.44) LMNAMAPTKDM4EMEN1KMT2A
SCHEMBL215644 0.87 KDM4E (0.41) LMNAMAPTKDM4ESIRT1MEN1
SCHEMBL214042 0.86 MAPT (0.43) LMNAMAPTKDM4EMEN1KMT2A
SCHEMBL214872 0.86 MAPT (0.42) LMNACACNA1GMAPTKDM4EKMT2A
SCHEMBL214789 0.86 KDM4E (0.47) KDM4ESIRT1MEN1KMT2AALDH1A1
SCHEMBL215084 0.86 MAPT (0.43) MAPTKDM4EMEN1KMT2AALDH1A1
SCHEMBL213712 0.86 MAPT (0.46) LMNAMAPTKDM4EMEN1KMT2A

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-8088767-B2 JAK-2 modulators and methods of use EXELIXIS, INC. (US) 2012-01-03 US claimed
US-20100136136-A1 JAK-2 Modulators and Methods of Use EXELIXIS, INC. (US) 2010-06-03 US claimed
EP-2061768-A2 IMIDAZOLE-4,5-DICARBOXAMIDE DERIVATIVES AS JAK-2 MODULATORS Exelixis, Inc. (US) 2009-05-27 EP claimed
WO-2008042282-A2 IMIDAZOLE-4, 5-DICARBOXAMIDE DERIVATIVES AS JAK-2 MODULATORS EXELIXIS, INC. (US) 2008-04-10 WO claimed
US-8088767-B2 JAK-2 modulators and methods of use EXELIXIS, INC. (US) 2012-01-03 US disclosed
US-20100136136-A1 JAK-2 Modulators and Methods of Use EXELIXIS, INC. (US) 2010-06-03 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 (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-20100136136-A1 JAK-2 Modulators and Methods of Use JAK2, JAK1, JAK3 EPHB3 2968/4885LMNA 4821/4885CACNA1G 4807/4885

“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.