SCHEMBL5146571

SCHEMBL5146571

CCCc1nc2c(N)nc3cc(-c4cccc(S(C)(=O)=O)c4)ccc3c2s1

nearest known ligand 0.57

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
TLR8 Q9NR97 13/20 0.57
TLR7 Q9NYK1 10/20 0.57
LIMK1 P53667 1/20 0.49
DHFR P00374 1/20 0.45
LOXL2 Q9Y4K0 1/20 0.40
CTSS P25774 1/20 0.40
CTSK P43235 1/20 0.40
NR1H2 P55055 2/20 0.39
NR1H3 Q13133 2/20 0.39
TARS1 P26639 1/20 0.39

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
SCHEMBL5146527 0.92 TLR8 (0.61) TLR8TLR7LIMK1LOXL2CTSS
SCHEMBL3988438 0.85 TLR8 (0.54) TLR8TLR7LIMK1DHFR
SCHEMBL5146429 0.82 TLR8 (0.61) TLR8TLR7
SCHEMBL3981001 0.82 TLR8 (0.60) TLR8TLR7LIMK1
SCHEMBL3503556 0.81 TLR8 (0.56) TLR8TLR7DHFR
SCHEMBL3980452 0.81 TLR8 (0.61) TLR8TLR7LIMK1DHFR
SCHEMBL5144714 0.80 TLR8 (0.54) TLR8TLR7LIMK1DHFR
SCHEMBL5144935 0.79 TLR8 (0.53) TLR8TLR7DHFR
SCHEMBL3503555 0.78 TLR8 (0.57) TLR8TLR7DHFR
SCHEMBL5144711 0.78 TLR8 (0.58) TLR8TLR7DHFR

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-20070259907-A1 ARYL AND ARYLALKYLENYL SUBSTITUTED THIAZOLOQUINOLINES AND THIAZOLONAPHTHYRIDINES 3M INNOVATIVE PROPERTIES COMPANY 2007-11-08 US disclosed
US-20070259907-A1 ARYL AND ARYLALKYLENYL SUBSTITUTED THIAZOLOQUINOLINES AND THIAZOLONAPHTHYRIDINES 3M INNOVATIVE PROPERTIES COMPANY 2007-11-08 US disclosed
US-20070259907-A1 ARYL AND ARYLALKYLENYL SUBSTITUTED THIAZOLOQUINOLINES AND THIAZOLONAPHTHYRIDINES 3M INNOVATIVE PROPERTIES COMPANY 2007-11-08 US disclosed
WO-2006093514-A2 ARYL AND ARYLALKYLENYL SUBSTITUTED THIAZOLOQUINOLINES AND THIAZOLONAPHTHYRIDINES 3M INNOVATIVE PROPERTIES COMPANY (US) 2006-09-08 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-20070259907-A1 ARYL AND ARYLALKYLENYL SUBSTITUTED THIAZOLOQUINOLINES AND THIAZOLONAPHTHYRIDINES IL2, TSLP, IFNG TLR8 86/4885TLR7 39/4885LIMK1 4662/4885

“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.