SCHEMBL3670575

SCHEMBL3670575

CN(CCO)Cc1ccc(-c2c[c]cnc2)cc1

nearest known ligand 0.38

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
LTA4H P09960 1/20 0.38
CHEK1 O14757 1/20 0.37
PYCR1 P32322 2/20 0.36
HRH3 Q9Y5N1 2/20 0.36
PRMT6 Q96LA8 2/20 0.35
HSD17B10 Q99714 1/20 0.35
S1PR1 P21453 1/20 0.34
SLC2A1 P11166 1/20 0.34
F10 P00742 1/20 0.33
PDCD1 Q15116 1/20 0.33
CD274 Q9NZQ7 1/20 0.33
MKNK1 Q9BUB5 1/20 0.33
MKNK2 Q9HBH9 1/20 0.33
TAAR1 Q96RJ0 1/20 0.33
BRAF P15056 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
SCHEMBL3672635 0.92 SIGMAR1 (0.36) LTA4HPYCR1HRH3PRMT6
SCHEMBL3724941 0.84 KDM4A (0.40) LTA4HPYCR1
SCHEMBL3667316 0.84 PDCD1 (0.39) LTA4HPRMT6HSD17B10PDCD1CD274
SCHEMBL3668815 0.82 HRH3 (0.57) PYCR1HRH3TAAR1
SCHEMBL4150523 0.81 LTA4H (0.38) LTA4HPYCR1HRH3F10CD274
SCHEMBL4165962 0.78 ALDH1A1 (0.33) PYCR1F10
SCHEMBL4151005 0.77 PRMT6 (0.37) PRMT6PDCD1CD274
SCHEMBL3662222 0.77 MKNK1 (0.53) CHEK1MKNK1MKNK2
SCHEMBL13778461 0.76 PRMT6 (0.43) LTA4HCHEK1HRH3PRMT6S1PR1
SCHEMBL4155265 0.76 KIF11 (0.31)

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
CN-101970435-B Pyrrolopyrimidines and pyrrolopyridines NOVARTIS AG 2014-07-02 CN claimed
US-8314112-B2 Pyrrolopyrimidines and pyrrolopyridines NOVARTIS AG (CH) 2012-11-20 US claimed
CN-101970435-A Pyrrolopyrimidines and pyrrolopyridines NOVARTIS AG 2011-02-09 CN claimed
EP-2242756-A2 PYRROLOPYRIMIDINES AND PYRROLOPYRIDINES Novartis AG (CH) 2010-10-27 EP claimed
US-20090181941-A1 Pyrrolopyrimidines and Pyrrolopyridines NOVARTIS AG (CH) 2009-07-16 US claimed
WO-2009087225-A2 PYRROLOPYRIMIDINES AND PYRROLOPYRIDINES NOVARTIS AG (CH) 2009-07-16 WO claimed

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-20090181941-A1 Pyrrolopyrimidines and Pyrrolopyridines ALK, ACVR1, PTPN4 LTA4H 729/4885CHEK1 2632/4885PYCR1 407/4885

“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.