SCHEMBL2574469

SCHEMBL2574469

C=CCNc1nc(C2CC2)cc2c1[nH]c(=O)n2Cc1ccccc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TLR7 Q9NYK1 7/20 0.44
DHFR P00374 2/20 0.40
HTR6 P50406 1/20 0.39
HSD17B10 Q99714 3/20 0.38
TP53 P04637 1/20 0.38
ALOX15 P16050 1/20 0.38
KMT2A Q03164 3/20 0.37
MEN1 O00255 2/20 0.37
LIPG Q9Y5X9 1/20 0.37
OPRM1 P35372 1/20 0.36
OPRD1 P41143 1/20 0.36
OPRK1 P41145 1/20 0.36
OGFRL1 Q5TC84 1/20 0.36
KDM4E B2RXH2 2/20 0.35
ALDH1A1 P00352 1/20 0.35
RAB9A P51151 1/20 0.35
GLA P06280 1/20 0.35
TSHR P16473 1/20 0.35
NPY1R P25929 1/20 0.35
MTOR P42345 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
SCHEMBL2572594 0.80 TLR7 (0.52) TLR7HTR6KMT2ALIPGALDH1A1
SCHEMBL2568873 0.79 TLR7 (0.67) TLR7ALDH1A1
SCHEMBL12164383 0.70 TLR7 (0.67) TLR7HTR6HSD17B10KMT2AMEN1
SCHEMBL2565121 0.68 TLR7 (0.49) TLR7HTR6KMT2AMEN1KDM4E
SCHEMBL2572120 0.68 TLR7 (0.69) TLR7
SCHEMBL2572680 0.67 NAPEPLD (0.50) TLR7
SCHEMBL2571268 0.67 TLR7 (0.54) TLR7HTR6KMT2AMEN1
SCHEMBL2572493 0.65 TLR7 (0.48) TLR7HTR6KMT2AMEN1KDM4E
SCHEMBL9303416 0.63 KDM4E (0.72) HSD17B10TP53ALOX15KMT2AMEN1
SCHEMBL2568652 0.62 TLR7 (1.00) TLR7KMT2AMEN1KDM4ETSHR

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
EP-1987030-B1 3 -DEAZAPURINE DERIVATIVES AS TLR7 MODULATORS PFIZER LTD (GB) 2011-11-09 EP disclosed
US-7691877-B2 Pharmaceuticals PFIZER INC. (US) 2010-04-06 US disclosed
EP-1987030-A1 3 -DEAZAPURINE DERIVATIVES AS TLR7 MODULATORS Pfizer Limited (GB) 2008-11-05 EP disclosed
WO-2007093901-A1 3 -DEAZAPURINE DERIVATIVES AS TLR7 MODULATORS PFIZER LIMITED (GB) 2007-08-23 WO disclosed
US-20070197478-A1 NOVEL PHARMACEUTICALS PFIZER LIMITED 2007-08-23 US 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-20070197478-A1 NOVEL PHARMACEUTICALS TLR3, HAVCR2, TLR9 TLR7 7/4885DHFR 1143/4885HTR6 1989/4885

“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.