SCHEMBL2401299

SCHEMBL2401299

CCc1nc2c(N)nc3cc(OCc4nc5ccccc5s4)ccc3c2s1

nearest known ligand 0.60

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
TLR8 Q9NR97 8/20 0.60
TLR7 Q9NYK1 8/20 0.60
NPC1 O15118 6/20 0.56
RAB9A P51151 6/20 0.56
MAPT P10636 3/20 0.56
L3MBTL1 Q9Y468 2/20 0.56
HTT P42858 1/20 0.56
SMN1; SMN2 Q16637 4/20 0.49
MAPK1 P28482 1/20 0.49
KMT2A Q03164 2/20 0.48
MEN1 O00255 1/20 0.45
ALDH1A1 P00352 1/20 0.45
PKM P14618 1/20 0.43
ALOX5 P09917 3/20 0.43
EPHX2 P34913 3/20 0.43
F9 P00740 1/20 0.42
F10 P00742 1/20 0.42

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
SCHEMBL2399101 0.85 TLR8 (0.65) TLR8TLR7ALOX5
SCHEMBL5087283 0.82 TLR8 (0.61) TLR8TLR7ALDH1A1
SCHEMBL12269842 0.79 TLR8 (0.53) TLR8TLR7
SCHEMBL2400670 0.79 TLR8 (0.53) TLR8TLR7ALOX5
SCHEMBL2400926 0.79 TLR7 (0.57) TLR8TLR7ALDH1A1
SCHEMBL2399936 0.78 TLR8 (0.56) TLR8TLR7ALDH1A1
SCHEMBL2400351 0.78 TLR8 (0.66) TLR8TLR7
SCHEMBL1528137 0.76 TLR8 (1.00) TLR8TLR7
Hydrochloric Acid SCHEMBL5767005 0.75 TLR8 (0.97) TLR8TLR7
SCHEMBL2401290 0.75 TLR8 (0.47) TLR8TLR7SMN1; SMN2KMT2AMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8026366-B2 Aryloxy and arylalkyleneoxy substituted thiazoloquinolines and thiazolonaphthyridines 3M INNOVATIVE PROPERTIES COMPANY (US) 2011-09-27 US disclosed
US-8026366-B2 Aryloxy and arylalkyleneoxy substituted thiazoloquinolines and thiazolonaphthyridines 3M INNOVATIVE PROPERTIES COMPANY (US) 2011-09-27 US disclosed
US-8026366-B2 Aryloxy and arylalkyleneoxy substituted thiazoloquinolines and thiazolonaphthyridines 3M INNOVATIVE PROPERTIES COMPANY (US) 2011-09-27 US disclosed
US-20070208052-A1 Aryloxy and arylalkyleneoxy substituted thiazoloquinolines and thiazolonaphthyridines 3M INNOVATIVE PROPERTIES COMPANY 2007-09-06 US disclosed
US-20070208052-A1 Aryloxy and arylalkyleneoxy substituted thiazoloquinolines and thiazolonaphthyridines 3M INNOVATIVE PROPERTIES COMPANY 2007-09-06 US disclosed
WO-2006009826-A1 ARYLOXY AND ARYLALKYLENEOXY SUBSTITUTED THIAZOLOQUINOLINES AND THIAZOLONAPHTHYRIDINES 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-20070208052-A1 Aryloxy and arylalkyleneoxy substituted thiazoloquinolines and thiazolonaphthyridines IL2, TSLP, IFNG TLR8 82/4885TLR7 37/4885NPC1 1748/4885

“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.