SCHEMBL843185

SCHEMBL843185

CNc1nc2c(N)nc3ccc(Cc4ccc(OC)cc4)c(Cc4ccc(OC)cc4)c3c2n1CC(C)C

nearest known ligand 0.41

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
TLR7 Q9NYK1 6/20 0.41
ALDH1A1 P00352 2/20 0.39
CYP2D6 P10635 1/20 0.39
ATM Q13315 1/20 0.39
DHFR P00374 1/20 0.34
MPO P05164 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
TLR8 Q9NR97 1/20 0.33
TP53 P04637 2/20 0.33
MDM4 O15151 1/20 0.33
MDM2 Q00987 1/20 0.33
LMNA P02545 2/20 0.32
POLB P06746 1/20 0.32
HTR2A P28223 1/20 0.32
HTR2C P28335 1/20 0.32
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
MAPT P10636 1/20 0.32
HPGD P15428 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
SCHEMBL843722 0.90 TLR7 (0.43) TLR7ALDH1A1CYP2D6ATMDHFR
SCHEMBL843723 0.75 TLR7 (0.46) TLR7ALDH1A1CYP2D6ATMDHFR
SCHEMBL29121439 0.74 ALDH1A1 (0.55) ALDH1A1CYP2D6ATMDHFRMPO
SCHEMBL29809256 0.74 ALDH1A1 (0.55) ALDH1A1CYP2D6ATMDHFRMPO
SCHEMBL842038 0.73 ALDH1A1 (0.44) TLR7ALDH1A1CYP2D6ATMMPO
SCHEMBL17799411 0.70 TLR7 (0.46) TLR7TLR8
SCHEMBL146930 0.69 TLR7 (0.58) TLR7TLR8LMNAPOLBHTR2A
SCHEMBL30447361 0.69 TLR7 (0.58) TLR7TLR8LMNAPOLBHTR2A
SCHEMBL29121426 0.67 ATM (0.46) ALDH1A1CYP2D6ATMMPONPSR1
SCHEMBL29809123 0.67 ATM (0.46) ALDH1A1CYP2D6ATMMPONPSR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8143270-B2 2-amino 1H-in-imidazo ring systems and methods 3M INNOVATIVE PROPERTIES COMPANY (US) 2012-03-27 US disclosed
EP-1784180-A4 2-AMINO 1H IMIDAZO RING SYSTEMS AND METHODS 3M INNOVATIVE PROPERTIES CO (US) 2009-07-22 EP disclosed
US-20090023720-A1 2-Amino 1H-Imidazo Ring Systems and Methods 3M INNOVATIVE PROPERTIES COMPANY 2009-01-22 US disclosed
EP-1784180-A2 2-AMINO 1H IMIDAZO RING SYSTEMS AND METHODS 3M INNOVATIVE PROPERTIES COMPANY (US) 2007-05-16 EP disclosed
WO-2006029115-A2 2-AMINO 1H IMIDAZO RING SYSTEMS AND METHODS 3M INNOVATIVE PROPERTIES COMPANY (US) 2006-03-16 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-20090023720-A1 2-Amino 1H-Imidazo Ring Systems and Methods IL2, IL2RA, IL4I1 TLR7 110/4885ALDH1A1 1223/4885CYP2D6 1504/4885

“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.