SCHEMBL15106914

SCHEMBL15106914

Cc1noc(C)c1-c1nc(N)cn1C

nearest known ligand 0.45

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
TLR8 Q9NR97 1/20 0.45
BRD4 O60885 11/20 0.41
BRD2 P25440 2/20 0.41
CYP1A2 P05177 4/20 0.37
USP2 O75604 2/20 0.37
ALDH1A1 P00352 2/20 0.37
JAK2 O60674 1/20 0.36
CYP3A4 P08684 2/20 0.36
CYP2C9 P11712 2/20 0.36
CYP2C19 P33261 1/20 0.36
HSD17B10 Q99714 1/20 0.36
CREBBP Q92793 1/20 0.35
PDE10A Q9Y233 1/20 0.35
TDO2 P48775 1/20 0.35
TSHR P16473 1/20 0.35
MAPK1 P28482 1/20 0.35
ATAD2 Q6PL18 1/20 0.35

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
SCHEMBL12800965 0.70 TLR8 (0.40) TLR8BRD4BRD2CYP1A2USP2
SCHEMBL15815057 0.67 AURKA (0.50) BRD4BRD2JAK2CREBBPATAD2
Hydrochloric Acid SCHEMBL15106898 0.67 TLR8 (0.43) TLR8BRD4BRD2CYP1A2ALDH1A1
SCHEMBL13982304 0.66 CYP1A2 (0.43) TLR8BRD4BRD2CYP1A2ALDH1A1
SCHEMBL15106910 0.66 TLR8 (0.33) TLR8BRD4BRD2
SCHEMBL5366019 0.64
SCHEMBL30420643 0.63 BRD4 (0.42) BRD4BRD2CYP1A2USP2JAK2
SCHEMBL12800390 0.63 BRD4 (0.43) BRD4BRD2JAK2CREBBPTDO2
SCHEMBL12427192 0.63 CYP1A2 (0.51) TLR8BRD4BRD2CYP1A2USP2
SCHEMBL29836739 0.63 BRD4 (0.46) TLR8BRD4BRD2CYP1A2USP2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20130183252-A1 COMPOUNDS THAT INHIBIT (BLOCK) BITTER TASTE IN COMPOSITION AND METHODS OF MAKING SAME SENOMYX, INC. (US) 2013-07-18 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-20130183252-A1 COMPOUNDS THAT INHIBIT (BLOCK) BITTER TASTE IN COMPOSITION AND METHODS OF MAKING SAME TAS2R50, TAS2R1, TAS2R5 TLR8 3044/4885BRD4 1044/4885BRD2 1090/4885

“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.