SCHEMBL311936

SCHEMBL311936

c1ccc(COc2ccc3c(c2)ncc2nc4n(c23)CCOC4)cc1

nearest known ligand 0.45

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
PRKDC P78527 3/20 0.45
NMT2 O60551 1/20 0.42
NMT1 P30419 1/20 0.42
GRM5 P41594 1/20 0.42
TP53 P04637 2/20 0.41
MAPT P10636 2/20 0.41
NPC1 O15118 2/20 0.41
RAB9A P51151 2/20 0.41
CYP3A4 P08684 1/20 0.40
KIT P10721 1/20 0.40
PARP14 Q460N5 1/20 0.40
GRM4 Q14833 1/20 0.40
ALDH1A1 P00352 1/20 0.39
MAOA P21397 1/20 0.39
MAOB P27338 1/20 0.39
CNR1 P21554 1/20 0.38
CNR2 P34972 1/20 0.38
PRMT5 O14744 1/20 0.38
ALOX5 P09917 1/20 0.38

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
SCHEMBL311081 0.83 PRKDC (0.43) PRKDCNMT2NMT1GRM5TP53
SCHEMBL1232966 0.80 MCHR1 (0.49) NMT1CYP3A4KITGRM4MAOB
SCHEMBL203370 0.80 MAOB (0.41) PRKDCNMT2NMT1NPC1RAB9A
SCHEMBL1233388 0.76 PRMT5 (0.39) NMT1CYP3A4KITGRM4PRMT5
SCHEMBL1232944 0.74 CYP8B1 (0.47) NMT1KITPRMT5
SCHEMBL1233682 0.73 CYP8B1 (0.44) NMT1KITPRMT5
SCHEMBL4239447 0.73 NPC1 (0.49) MAPTNPC1RAB9ACYP3A4KIT
SCHEMBL2059219 0.71 BRD4 (0.44) PRKDCNMT2NMT1CYP3A4KIT
SCHEMBL1486838 0.71 BRD4 (0.46) NMT2NMT1CYP3A4KITPARP14
SCHEMBL21865485 0.70 CYP3A4 (0.51) PRKDCNMT2NMT1CYP3A4ALDH1A1

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-8093390-B2 Substituted fused [1,2]imidazo[4,5-C] ring compounds and methods 3M INNOVATIVE PROPERTIES COMPANY (US) 2012-01-10 US disclosed
US-20090005371-A1 Substituted Fused [1,2]Imidazo[4,5-C] Ring Compounds and Methods 3M INNOVATIVE PROPERTIES COMPANY 2009-01-01 US disclosed
EP-1845986-A2 SUBSTITUTED FUSED [1,2]IMIDAZO[4,5-C]RING COMPOUNDS AND METHODS Coley Pharmaceutical Group, Inc. (US) 2007-10-24 EP disclosed
WO-2006086633-A2 SUBSTITUTED FUSED [1,2]IMIDAZO[4,5-C] RING COMPOUNDS AND METHODS COLEY PHARMACEUTICAL GROUP, INC. (US) 2006-08-17 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-20090005371-A1 Substituted Fused [1,2]Imidazo[4,5-C] Ring Compounds and Methods IL2, IFNG, IL4 PRKDC 3764/4885NMT2 3470/4885NMT1 3988/4885

“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.