SCHEMBL214460

SCHEMBL214460

NC(=O)c1c(C(=O)Nc2c(Cl)cccc2Cl)ncn1-c1nc2ccc(Cl)cc2[nH]1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TP53 P04637 3/20 0.39
EGLN1 Q9GZT9 1/20 0.39
DGAT1 O75907 1/20 0.39
MAPT P10636 1/20 0.38
LCK P06239 1/20 0.38
IRAK4 Q9NWZ3 1/20 0.38
HPGD P15428 2/20 0.37
NPC1 O15118 1/20 0.37
TSHR P16473 1/20 0.37
NFKB1 P19838 1/20 0.37
RAB9A P51151 1/20 0.37
GFER P55789 1/20 0.37
NFKB2 Q00653 1/20 0.37
RELA Q04206 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
CHEK2 O96017 2/20 0.36
HRH4 Q9H3N8 1/20 0.36
TRPV1 Q8NER1 1/20 0.35
KMT2A Q03164 2/20 0.35
KDM4E B2RXH2 1/20 0.35

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
SCHEMBL213658 0.94 MAPT (0.39) TP53EGLN1DGAT1MAPTIRAK4
SCHEMBL214976 0.89 LCK (0.44) TP53MAPTLCKHPGDNPC1
SCHEMBL213712 0.83 MAPT (0.46) TP53MAPTLCKHPGDNPC1
SCHEMBL215203 0.82 STK33 (0.40) EGLN1MAPTNPC1TSHRRAB9A
SCHEMBL214646 0.80 EPHB3 (0.44) MAPTTSHRSMN1; SMN2KMT2AKDM4E
SCHEMBL215084 0.80 MAPT (0.43) MAPTHPGDNPC1RAB9ASMN1; SMN2
SCHEMBL214938 0.79 MAPT (0.47) TP53MAPTHPGDNPC1RAB9A
SCHEMBL214450 0.78 LMNA (0.54) MAPTHPGDNPC1RAB9ASMN1; SMN2
SCHEMBL215132 0.78 CYP3A4 (0.44) TP53MAPTHPGDNPC1RAB9A
SCHEMBL213458 0.77 LMNA (0.41) TP53MAPTHPGDNPC1RAB9A

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
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
EP-2061768-A2 IMIDAZOLE-4,5-DICARBOXAMIDE DERIVATIVES AS JAK-2 MODULATORS Exelixis, Inc. (US) 2009-05-27 EP disclosed
WO-2008042282-A2 IMIDAZOLE-4, 5-DICARBOXAMIDE DERIVATIVES AS JAK-2 MODULATORS EXELIXIS, INC. (US) 2008-04-10 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-20100136136-A1 JAK-2 Modulators and Methods of Use JAK2, JAK1, JAK3 TP53 1743/4885EGLN1 2341/4885DGAT1 3518/4885

“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.