SCHEMBL214765

SCHEMBL214765

Cc1ccc(C)c(NC(=O)c2nc[nH]c2C(=O)N2CCN(c3ncccn3)CC2)c1

nearest known ligand 0.59

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.59
TDP1 Q9NUW8 1/20 0.59
USP2 O75604 1/20 0.56
POLB P06746 1/20 0.54
L3MBTL1 Q9Y468 1/20 0.50
KMT2A Q03164 1/20 0.48
SLC6A7 Q99884 1/20 0.47
GFER P55789 1/20 0.46
RAB9A P51151 1/20 0.46
ALDH1A1 P00352 1/20 0.45
LMNA P02545 1/20 0.45
GAA P10253 1/20 0.45

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
SCHEMBL214002 0.78 KDM4E (0.53) KDM4ETDP1USP2POLBL3MBTL1
SCHEMBL212939 0.78 KDM4E (0.62) KDM4ETDP1USP2POLBL3MBTL1
SCHEMBL214570 0.76 GAA (0.55) KDM4ETDP1USP2L3MBTL1KMT2A
SCHEMBL214968 0.75 USP2 (0.60) KDM4ETDP1USP2POLBKMT2A
SCHEMBL14222699 0.74 MAPT (0.78) KDM4ETDP1L3MBTL1KMT2AALDH1A1
SCHEMBL14222951 0.72 MAPT (0.67) KDM4ETDP1L3MBTL1KMT2ARAB9A
SCHEMBL14222705 0.70 MAPT (0.67) KDM4ETDP1L3MBTL1KMT2AALDH1A1
SCHEMBL2735385 0.68 NPC1 (0.54) KDM4EKMT2ARAB9AALDH1A1LMNA
SCHEMBL14222310 0.67 MAPT (0.50) KDM4ETDP1L3MBTL1KMT2ARAB9A
SCHEMBL4105577 0.67 GAA (0.55) KDM4ETDP1USP2POLBL3MBTL1

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 11 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-8088767-B2 JAK-2 modulators and methods of use EXELIXIS, INC. (US) 2012-01-03 US disclosed
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
US-20100136136-A1 JAK-2 Modulators and Methods of Use EXELIXIS, INC. (US) 2010-06-03 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
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 KDM4E 952/4885TDP1 3233/4885USP2 615/4885

“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.