SCHEMBL214140

SCHEMBL214140

COc1ccc(C)c(N(C(=O)c2nc[nH]c2C(N)=O)c2nc3ccccc3[nH]2)c1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.48
RAB9A P51151 8/20 0.37
NPC1 O15118 7/20 0.37
KMT2A Q03164 7/20 0.37
KDM4E B2RXH2 2/20 0.37
MEN1 O00255 5/20 0.36
RXFP1 Q9HBX9 1/20 0.36
MAPT P10636 5/20 0.36
SMN1; SMN2 Q16637 4/20 0.36
PKM P14618 2/20 0.36
ALDH1A1 P00352 3/20 0.36
EPHB4 P54760 1/20 0.35
LMNA P02545 1/20 0.35
TLR9 Q9NR96 1/20 0.35
TP53 P04637 1/20 0.35
FAAH O00519 1/20 0.35
MAPK10 P53779 1/20 0.35
ATP4A P20648 1/20 0.35
ATP4B P51164 1/20 0.35
DRD2 P14416 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
SCHEMBL213394 0.93 POLB (0.48) POLBRAB9ANPC1KMT2AKDM4E
SCHEMBL214764 0.91 POLB (0.48) POLBRAB9ANPC1KMT2AKDM4E
SCHEMBL214043 0.90 POLB (0.47) POLBRAB9ANPC1KMT2AKDM4E
SCHEMBL216094 0.90 POLB (0.48) POLBRAB9ANPC1KMT2AKDM4E
SCHEMBL216492 0.89 POLB (0.37) POLBRAB9ANPC1KMT2AKDM4E
SCHEMBL214338 0.88 POLB (0.36) POLBRAB9ANPC1KMT2AKDM4E
SCHEMBL215894 0.88 POLB (0.36) POLBRAB9ANPC1KMT2AKDM4E
SCHEMBL214939 0.88 POLB (0.36) POLBRAB9ANPC1KMT2AKDM4E
SCHEMBL216562 0.87 POLB (0.64) POLBRAB9ANPC1KMT2AKDM4E
SCHEMBL214715 0.87 POLB (0.40) POLBRAB9ANPC1KMT2AKDM4E

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 8 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
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 POLB 3464/4885RAB9A 2213/4885NPC1 3307/4885

“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.