SCHEMBL11849

SCHEMBL11849

Cc1c(F)ccc2cc(C(C)NC(=O)O)c(SCC(N)=O)nc12

nearest known ligand 0.39

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 5/20 0.39
MEN1 O00255 4/20 0.39
ALDH1A1 P00352 3/20 0.39
MAPT P10636 2/20 0.39
LMNA P02545 1/20 0.36
RXFP1 Q9HBX9 2/20 0.35
SMN1; SMN2 Q16637 2/20 0.35
TSHR P16473 1/20 0.34
MAPK1 P28482 1/20 0.34
KDM4E B2RXH2 1/20 0.34
ACP1 P24666 2/20 0.34
PTPN7 P35236 2/20 0.34
PTPN12 Q05209 2/20 0.34
PTPN22 Q9Y2R2 2/20 0.34
IDO1 P14902 1/20 0.33
GAA P10253 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
PRNP P04156 1/20 0.32

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
SCHEMBL14482160 0.85 MEN1 (0.35) KMT2AMEN1ALDH1A1MAPTLMNA
SCHEMBL14482213 0.80 NOTUM (0.34) KMT2AMEN1ALDH1A1MAPTLMNA
SCHEMBL716685 0.77 L3MBTL1 (0.34) KMT2AMEN1SMN1; SMN2L3MBTL1
SCHEMBL863617 0.74 ALDH1A1 (0.35) KMT2AMEN1ALDH1A1MAPTLMNA
SCHEMBL11850 0.73 MEN1 (0.42) KMT2AMEN1ALDH1A1MAPTLMNA
SCHEMBL715924 0.72 OPRK1 (0.41) ALDH1A1MAPTKDM4E
SCHEMBL863915 0.72 CDK5 (0.39) ALDH1A1RXFP1MAPK1KDM4EIDO1
SCHEMBL715385 0.71 OPRK1 (0.43) KMT2AALDH1A1MAPTRXFP1SMN1; SMN2
SCHEMBL715806 0.70 OPRK1 (0.36)
SCHEMBL715807 0.70 OPRK1 (0.36)

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8957090-B2 Fused bicyclic pyridine and pyrazine derivatives as kinase inhibitors UCB PHARMA S.A. (BE) 2015-02-17 US disclosed
EP-2499126-B1 FUSED BICYCLIC PYRIDINE AND PYRAZINE DERIVATIVES AS KINASE INHIBITORS UCB PHARMA SA (BE) 2015-01-07 EP disclosed
US-20130012515-A1 Fused Bicyclic Pyridine and Pyrazine Derivatives as Kinase Inhibitors UCB PHARMA S.A. (BE) 2013-01-10 US disclosed
EP-2499126-A1 FUSED BICYCLIC PYRIDINE AND PYRAZINE DERIVATIVES AS KINASE INHIBITORS UCB Pharma, S.A. (BE) 2012-09-19 EP disclosed
WO-2011058113-A1 FUSED BICYCLIC PYRIDINE AND PYRAZINE DERIVATIVES AS KINASE INHIBITORS UCB PHARMA S.A. (BE) 2011-05-19 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-20130012515-A1 Fused Bicyclic Pyridine and Pyrazine Derivatives as Kinase Inhibitors MAP3K13, MAP3K15, MAP3K12 KMT2A 2748/4885MEN1 3445/4885ALDH1A1 3761/4885

“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.