SCHEMBL5456946

SCHEMBL5456946

CC(C)(O)Cn1c(CN2C(=O)c3ccccc3C2=O)nc2cnc3cccnc3c21

nearest known ligand 0.44

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.44
NPSR1 Q6W5P4 2/20 0.43
TSHR P16473 2/20 0.42
PTK2B Q14289 1/20 0.42
RAB9A P51151 1/20 0.41
GAA P10253 1/20 0.39
TLR7 Q9NYK1 7/20 0.38
USP2 O75604 1/20 0.38
ALDH1A1 P00352 2/20 0.38
MEN1 O00255 1/20 0.38
PKM P14618 1/20 0.38
KMT2A Q03164 1/20 0.38
GRM5 P41594 1/20 0.37
PDE10A Q9Y233 1/20 0.36
TLR8 Q9NR97 2/20 0.36
PIK3CA P42336 1/20 0.35
NUDT1 P36639 1/20 0.35

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
SCHEMBL5463569 0.81 TLR7 (0.41) TLR7TLR8PIK3CANUDT1
SCHEMBL1490839 0.81 TLR7 (0.41) TLR7MEN1KMT2ATLR8NUDT1
SCHEMBL3355129 0.80 TLR7 (0.44) NPSR1TLR7MEN1KMT2ATLR8
SCHEMBL5115537 0.79 STING1 (0.42) TSHRPTK2BTLR7
SCHEMBL6278132 0.78 TSHR (0.46) POLBNPSR1TSHRPTK2BRAB9A
SCHEMBL3354979 0.78 TLR7 (0.55) TLR7TLR8NUDT1
SCHEMBL5462363 0.78 L3MBTL1 (0.43) TLR7
SCHEMBL1895061 0.77 TLR7 (0.56) TSHRTLR7MEN1KMT2ATLR8
SCHEMBL5470719 0.75 TLR7 (0.65) NPSR1TSHRPTK2BTLR7TLR8
SCHEMBL5481148 0.74 TLR7 (0.40) POLBTLR7ALDH1A1PKM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070259881-A1 Substituted Imidazo Ring Systems and Methods COLEY PHARMACEUTICAL GROUP, INC. 2007-11-08 US disclosed
WO-2006009832-A1 SUBSTITUTED IMIDAZO RING SYSTEMS AND METHODS 3M INNOVATIVE PROPERTIES COMPANY (US) 2006-01-26 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-20070259881-A1 Substituted Imidazo Ring Systems and Methods IL2, IL4, IRF3 POLB 3903/4885NPSR1 3420/4885TSHR 399/4885

“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.