SCHEMBL3666969

SCHEMBL3666969

O=C(O)CNCc1cccc(-c2c[c]cnc2)c1

nearest known ligand 0.47

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
VSIR Q9H7M9 1/20 0.43
PRMT6 Q96LA8 2/20 0.43
EPHX2 P34913 1/20 0.43
KDM4C Q9H3R0 1/20 0.41
FFAR1 O14842 3/20 0.41
FFAR4 Q5NUL3 1/20 0.41
PDCD1 Q15116 4/20 0.39
CD274 Q9NZQ7 4/20 0.39
AOC3 Q16853 2/20 0.39
MEP1B Q16820 1/20 0.39
FNTA P49354 1/20 0.38
FNTB P49356 1/20 0.38
PGGT1B P53609 1/20 0.38
SCN8A Q9UQD0 1/20 0.37
GYS1 P13807 1/20 0.36
NR4A2 P43354 1/20 0.36

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
SCHEMBL3663779 0.90 FFAR1 (0.42) VSIRPRMT6EPHX2KDM4CFFAR1
SCHEMBL4152914 0.87 PRMT6 (0.43) VSIRPRMT6EPHX2KDM4CPDCD1
SCHEMBL3668234 0.84 FFAR1 (0.37) KDM4CFFAR1FFAR4NR4A2
SCHEMBL3724410 0.83 FFAR1 (0.48) FFAR1FFAR4
SCHEMBL3730365 0.83 GRIN2D (0.47) PRMT6EPHX2
SCHEMBL3666546 0.82 PRMT6 (0.48) VSIRPRMT6EPHX2PDCD1CD274
SCHEMBL3664072 0.80 SCN8A (0.46) VSIRPRMT6EPHX2PDCD1CD274
SCHEMBL3724194 0.80 PRMT6 (0.66) PRMT6EPHX2KDM4CSCN8A
SCHEMBL4173616 0.79 PRMT6 (0.42) PRMT6KDM4CFFAR1AOC3
SCHEMBL13778407 0.79 VSIR (0.49) VSIRPRMT6EPHX2KDM4CFFAR1

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
CN-101970435-B Pyrrolopyrimidines and pyrrolopyridines NOVARTIS AG 2014-07-02 CN 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 VSIR 3811/4885PRMT6 1956/4885EPHX2 3222/4885

“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.