SCHEMBL4986988

SCHEMBL4986988

CCCCCCCCc1c(C)nc(N)nc1Cl

nearest known ligand 0.55

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
TLR8 Q9NR97 15/20 0.55
TLR7 Q9NYK1 9/20 0.55
NPSR1 Q6W5P4 1/20 0.44
LMNA P02545 1/20 0.40
GAA P10253 1/20 0.40
MAPT P10636 1/20 0.40
ATM Q13315 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40

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
SCHEMBL6419045 1.00 TLR8 (0.55) TLR8TLR7NPSR1LMNAGAA
SCHEMBL6416413 0.93 TLR8 (0.56) TLR8TLR7NPSR1
SCHEMBL12495463 0.91 TLR8 (0.47) TLR8TLR7LMNAGAAMAPT
SCHEMBL3830025 0.89 TLR8 (0.49) TLR8TLR7NPSR1LMNAGAA
SCHEMBL8515321 0.87 NPSR1 (0.47) TLR8TLR7NPSR1
SCHEMBL12496379 0.83 TLR8 (0.47) TLR8TLR7NPSR1
SCHEMBL9203920 0.81 NPSR1 (0.49) TLR8TLR7NPSR1
SCHEMBL9499496 0.79 TLR8 (0.60) TLR8TLR7
SCHEMBL3458103 0.79 NPSR1 (0.50) TLR8TLR7NPSR1MAPTL3MBTL1
SCHEMBL6419615 0.79 TLR8 (0.55) TLR8TLR7GAAATM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080176744-A1 Use of 4-Aminopyrimidines for Controlling Harmful Fungi, Novel 4-Aminopyrimidines, Processes for Their Preparation and Compositions Comprising Them BASF AKTIENGESELLSCHAFT (DE) 2008-07-24 US disclosed
EP-1858327-A1 USE OF 4-AMINOPYRIMIDINES FOR THE PREVENTION OF FUNGAL PESTS NOVEL 4-AMINOPYRIMIDINES METHOD FOR PRODUCTION THEREOF AND AGENTS COMPRISING THE SAME BASF AKTIENGESELLSCHAFT (DE) 2007-11-28 EP disclosed
WO-2006094994-A1 USE OF 4-AMINOPYRIMIDINES FOR THE PREVENTION OF FUNGAL PESTS NOVEL 4-AMINOPYRIMIDINES METHOD FOR PRODUCTION THEREOF AND AGENTS COMPRISING THE SAME BASF AKTIENGESELLSCHAFT (DE) 2006-09-14 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-20080176744-A1 Use of 4-Aminopyrimidines for Controlling Harmful Fungi, Novel 4-Aminopyrimidines, Processes for Their Preparation and Compositions Comprising Them RRM2B, CBR3, RRM2 TLR8 3417/4885TLR7 3670/4885NPSR1 2796/4885

“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.