SCHEMBL214926

SCHEMBL214926

Cc1ccc(Br)cc1-n1cnc(C(N)=O)c1C(=O)Nc1nc2cc(Cl)ccc2[nH]1

nearest known ligand 0.39

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 8/20 0.37
NPC1 O15118 7/20 0.37
POLB P06746 1/20 0.37
KLF5 Q13887 1/20 0.37
TDP1 Q9NUW8 1/20 0.37
KDM4E B2RXH2 1/20 0.37
LMNA P02545 1/20 0.37
MAPT P10636 1/20 0.37
HCAR1 Q9BXC0 1/20 0.37
MEN1 O00255 4/20 0.37
KMT2A Q03164 4/20 0.37
JAK2 O60674 3/20 0.36
JAK1 P23458 1/20 0.36
TYK2 P29597 1/20 0.36
BRAF P15056 1/20 0.36
HRH4 Q9H3N8 1/20 0.35
RXFP1 Q9HBX9 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.33

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
SCHEMBL215374 0.91 ABL1 (0.37) RAB9ANPC1KDM4ELMNAMAPT
SCHEMBL214517 0.90 RAB9A (0.37) RAB9ANPC1KDM4ELMNAMAPT
SCHEMBL215845 0.87 IRAK4 (0.39) RAB9ANPC1KDM4ELMNAMAPT
SCHEMBL214920 0.85 MAPK14 (0.42)
SCHEMBL214506 0.85 MAPK14 (0.34) RAB9ANPC1KDM4ELMNAMAPT
Hydrochloric Acid SCHEMBL215304 0.84 MAPK14 (0.34) RAB9ANPC1KDM4ELMNAMAPT
SCHEMBL214609 0.84 MAOB (0.46) RAB9ANPC1KDM4ELMNAMAPT
SCHEMBL216298 0.83 HRH4 (0.43) JAK2HRH4
SCHEMBL214940 0.83 HDAC6 (0.38) RAB9ANPC1POLBKDM4ELMNA
SCHEMBL214823 0.83 CHEK2 (0.35) RAB9ANPC1KDM4ELMNAMAPT

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

“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.