SCHEMBL2806860

SCHEMBL2806860

CC(C)(C)N(OCc1nc2cnc3ccccc3c2s1)C(=O)O

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TLR8 Q9NR97 5/20 0.37
CYP1A2 P05177 1/20 0.37
CYP2C19 P33261 1/20 0.37
KMT2A Q03164 3/20 0.36
NPC1 O15118 5/20 0.36
ALOX5 P09917 2/20 0.36
EPHX2 P34913 2/20 0.36
HTT P42858 1/20 0.36
TLR7 Q9NYK1 2/20 0.36
RAB9A P51151 4/20 0.36
MEN1 O00255 2/20 0.36
GAA P10253 1/20 0.36
RXFP1 Q9HBX9 1/20 0.35
SMN1; SMN2 Q16637 2/20 0.35
ALDH1A1 P00352 1/20 0.35
MAPT P10636 1/20 0.35
DUSP10 Q9Y6W6 1/20 0.34
MAPK1 P28482 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
TP53 P04637 1/20 0.34

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
SCHEMBL2807850 0.82 TLR8 (0.57) TLR8TLR7
SCHEMBL4970650 0.78 KMT2A (0.40) TLR8CYP1A2CYP2C19KMT2ANPC1
SCHEMBL2807423 0.78 CYP1A2 (0.61) CYP1A2CYP2C19KMT2ANPC1HTT
SCHEMBL1528140 0.76 SMN1; SMN2 (0.43) TLR8CYP1A2CYP2C19KMT2ANPC1
SCHEMBL2809228 0.74 NPC1 (0.41) TLR8CYP1A2CYP2C19KMT2ANPC1
SCHEMBL1528127 0.74 TLR8 (0.41) TLR8CYP1A2CYP2C19KMT2ANPC1
SCHEMBL1528013 0.74 TLR7 (0.40) TLR8CYP1A2TLR7DUSP10
SCHEMBL13128110 0.73 NPC1 (0.40) TLR8CYP1A2CYP2C19KMT2ANPC1
SCHEMBL1527945 0.71 TLR8 (0.56) TLR8NPC1TLR7RAB9AGAA
SCHEMBL4970653 0.70 ALOX15 (0.38) CYP1A2CYP2C19KMT2ANPC1HTT

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-8378102-B2 Oxime and hydroxylamine substituted thiazolo[4,5-c] ring compounds and methods 3M INNOVATIVE PROPERTIES COMPANY (US) 2013-02-19 US disclosed
US-20100240693-A1 Oxime and Hydroxylamine Substituted Thiazolo [4,5-C] Ring Compounds and Methods COLEY PHARMACEUTICAL GROUP, INC (US) 2010-09-23 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-20100240693-A1 Oxime and Hydroxylamine Substituted Thiazolo [4,5-C] Ring Compounds and Methods IL4, IL2, TH TLR8 203/4885CYP1A2 352/4885CYP2C19 491/4885

“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.