SCHEMBL214029

SCHEMBL214029

Cc1ccc(Br)cc1-n1cnc(C(N)=O)c1C(=O)Nc1ccc(OCc2ccccc2)cc1

nearest known ligand 0.46

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.46
RAB9A P51151 9/20 0.46
NPC1 O15118 8/20 0.46
MEN1 O00255 4/20 0.46
KMT2A Q03164 4/20 0.46
SMN1; SMN2 Q16637 5/20 0.45
ALDH1A1 P00352 3/20 0.45
PKM P14618 1/20 0.45
GPR55 Q9Y2T6 1/20 0.44
LTA4H P09960 2/20 0.43
LMNA P02545 1/20 0.42
POLB P06746 1/20 0.42
NPSR1 Q6W5P4 1/20 0.42
LRRK2 Q5S007 1/20 0.42
NOX1 Q9Y5S8 1/20 0.41

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
Hydrochloric Acid SCHEMBL215995 0.80 KDM1A (0.40) RAB9ANPC1SMN1; SMN2LMNAPOLB
Hydrochloric Acid SCHEMBL215124 0.71 KDM1A (0.39) MAPTRAB9AMEN1KMT2ASMN1; SMN2
SCHEMBL214030 0.70 MAPT (0.60) MAPTRAB9ANPC1MEN1KMT2A
SCHEMBL14023576 0.70 NPC1 (0.60) MAPTRAB9ANPC1MEN1KMT2A
SCHEMBL214940 0.70 HDAC6 (0.38) MAPTRAB9ANPC1MEN1KMT2A
SCHEMBL213893 0.69 MAPT (0.35) MAPT
SCHEMBL215845 0.69 IRAK4 (0.39) MAPTRAB9ANPC1MEN1KMT2A
SCHEMBL2367941 0.67 TP53 (0.52) MAPTRAB9ANPC1MEN1KMT2A
SCHEMBL14023585 0.67 LRRK2 (0.59) MAPTRAB9ANPC1MEN1KMT2A
SCHEMBL4598560 0.66 LTA4H (0.75) RAB9ANPC1MEN1KMT2ASMN1; SMN2

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 4 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 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 MAPT 2138/4885RAB9A 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.