SCHEMBL4530388

SCHEMBL4530388

CC(C)(O)Cn1cnc2cnc3cc(Br)ccc3c21

nearest known ligand 0.44

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
TLR7 Q9NYK1 2/20 0.44
MCL1 Q07820 1/20 0.35
CHEK1 O14757 1/20 0.35
FLT3 P36888 1/20 0.35
USP7 Q93009 2/20 0.34
LMNA P02545 1/20 0.33
ABL1 P00519 1/20 0.33
DDR1 Q08345 2/20 0.32
EGLN1 Q9GZT9 1/20 0.32
PTGES O14684 4/20 0.31
ALDH1A1 P00352 1/20 0.31

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
SCHEMBL20786904 0.82 MCL1 (0.46) MCL1CHEK1FLT3USP7LMNA
SCHEMBL9387631 0.81 TLR7 (0.61) TLR7LMNA
Water SCHEMBL10743629 0.80 TLR7 (0.60) TLR7LMNA
SCHEMBL3868134 0.80 TLR7 (0.48) TLR7CHEK1FLT3EGLN1
SCHEMBL3867965 0.79 TLR7 (0.42) TLR7MCL1USP7LMNAPTGES
SCHEMBL4531190 0.78 TLR7 (0.71) TLR7LMNAPTGES
SCHEMBL29463859 0.78 NPC1 (0.44) TLR7MCL1LMNA
SCHEMBL12144994 0.78 NPC1 (0.44) TLR7MCL1LMNA
SCHEMBL1486542 0.77 TLR7 (0.46) TLR7
SCHEMBL3862141 0.76 TLR7 (0.45) TLR7

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-8658666-B2 Substituted imidazoquinolines and imidazonaphthyridines 3M INNOVATIVE PROPERTIES COMPANY (US) 2014-02-25 US disclosed
US-20090099161-A1 Substituted Imidazoquinolines and Imidazonaphthyridines COLEY PHARMACEUTIAL GROUP, INC. (NY) 2009-04-16 US disclosed
EP-1845988-A2 SUBSTITUTED IMIDAZOQUINOLINES AND IMIDAZONAPHTHYRIDINES 3M Innovative Properties Company (US) 2007-10-24 EP disclosed
WO-2006091394-A2 SUBSTITUTED IMIDAZOQUINOLINES AND IMIDAZONAPHTHYRIDINES COLEY PHARMACEUTICAL GROUP, INC. (US) 2006-08-31 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-20090099161-A1 Substituted Imidazoquinolines and Imidazonaphthyridines IL2, EIF2AK2, IFNG TLR7 35/4885MCL1 288/4885CHEK1 1558/4885

“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.