SCHEMBL4153283

SCHEMBL4153283

CCCc1nc2cnc3ccccc3c2n1CCCCCC(=O)N(C)OC

nearest known ligand 0.41

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
TLR7 Q9NYK1 8/20 0.41
SMN1; SMN2 Q16637 2/20 0.40
RXFP1 Q9HBX9 1/20 0.39
ACKR3 P25106 2/20 0.38
LMNA P02545 1/20 0.38
TP53 P04637 1/20 0.38
TLR8 Q9NR97 1/20 0.38
RECQL P46063 1/20 0.37
FAAH O00519 1/20 0.37

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
SCHEMBL4139693 1.00 TLR7 (0.41) TLR7SMN1; SMN2RXFP1ACKR3LMNA
SCHEMBL4150619 0.99 SMN1; SMN2 (0.41) TLR7SMN1; SMN2RXFP1ACKR3LMNA
SCHEMBL4145955 0.96 TLR7 (0.41) TLR7SMN1; SMN2RXFP1ACKR3
SCHEMBL31006026 0.87 TLR7 (0.39) TLR7TLR8
SCHEMBL483649 0.87 TLR7 (0.39) TLR7TLR8
SCHEMBL4138665 0.86 FAAH (0.50) TLR7SMN1; SMN2FAAH
SCHEMBL4011233 0.86 FAAH (0.50) TLR7SMN1; SMN2FAAH
SCHEMBL5617050 0.85 TLR7 (0.46) TLR7SMN1; SMN2LMNATP53TLR8
SCHEMBL4148792 0.85 TLR7 (0.46) TLR7SMN1; SMN2LMNATP53TLR8
SCHEMBL4155601 0.85 TLR7 (0.46) TLR7SMN1; SMN2LMNATP53TLR8

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9765071-B2 Substituted imidazo ring systems and methods 3M INNOVATIVE PROPERTIES COMPANY (US) 2017-09-19 US disclosed
US-20160194322-A1 SUBSTITUTED IMIDAZO RING SYSTEMS AND METHODS 3M INNOVATIVE PROPERTIES CO (US) 2016-07-07 US disclosed
US-9328110-B2 Substituted imidazo ring systems and methods 3M INNOVATIVE PROPERTIES COMPANY (US) 2016-05-03 US disclosed
EP-1687307-B1 SUBSTITUTED IMIDAZO RING SYSTEMS AND METHODS 3M INNOVATIVE PROPERTIES CO (US) 2016-01-06 EP disclosed
US-20140194628-A1 SUBSTITUTED IMIDAZO RING SYSTEMS AND METHODS 3M INNOVATIVE PROPERTIES COMPANY (US) 2014-07-10 US disclosed
EP-1687307-A4 SUBSTITUTED IMIDAZO RING SYSTEMS AND METHODS 3M INNOVATIVE PROPERTIES CO (US) 2009-06-17 EP disclosed
US-20070072893-A1 Substituted imidazo ring systems and methods 3M INNOVATIVE PROPERTIES COMPANY 2007-03-29 US disclosed
EP-1687307-A2 SUBSTITUTED IMIDAZO RING SYSTEMS AND METHODS 3M Innovative Properties Company (US) 2006-08-09 EP disclosed
WO-2005051317-A2 SUBSTITUTED IMIDAZO RING SYSTEMS AND METHODS 3M INNOVATIVE PROPERTIES COMPANY (US) 2005-06-09 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 (3 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-20070072893-A1 Substituted imidazo ring systems and methods IL2, IRF3, EIF2AK2 TLR7 162/4885SMN1; SMN2 3448/4885RXFP1 3057/4885
US-20160194322-A1 SUBSTITUTED IMIDAZO RING SYSTEMS AND METHODS IL2, IRF3, EIF2AK2 TLR7 155/4885SMN1; SMN2 3376/4885RXFP1 3719/4885
US-20140194628-A1 SUBSTITUTED IMIDAZO RING SYSTEMS AND METHODS IL2, IRF3, EIF2AK2 TLR7 155/4885SMN1; SMN2 3376/4885RXFP1 3719/4885

“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.