SCHEMBL6833712

SCHEMBL6833712

FC(F)(F)c1nc2ccccc2c2c1nc(C1CCCCC1)n2CCC1CCNCC1

nearest known ligand 0.46

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ADORA3 P0DMS8 2/20 0.46
TLR7 Q9NYK1 7/20 0.41
USP2 O75604 1/20 0.38
POLB P06746 1/20 0.38
NPY1R P25929 1/20 0.37
ATM Q13315 1/20 0.36
RXRA P19793 1/20 0.36
RXRB P28702 1/20 0.36
RXRG P48443 1/20 0.36
HTR4 Q13639 1/20 0.36
TP53 P04637 2/20 0.35
MAPT P10636 2/20 0.35
CHRM1 P11229 1/20 0.34
HRH1 P35367 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
SCHEMBL6838758 0.99 ADORA3 (0.45) ADORA3TLR7USP2POLBNPY1R
SCHEMBL6833984 0.88 ADORA3 (0.37) ADORA3TLR7NPY1RRXRARXRB
SCHEMBL6837685 0.87 ADORA3 (0.40) ADORA3NPY1RTP53MAPT
SCHEMBL6833816 0.87 ADORA3 (0.37) ADORA3TLR7POLBRXRARXRB
SCHEMBL6838083 0.87 ADORA3 (0.36) ADORA3NPY1RCHRM1HRH1
SCHEMBL7488417 0.86 NPY1R (0.36) ADORA3TLR7NPY1RRXRARXRB
SCHEMBL6838584 0.86 ADORA3 (0.39) ADORA3NPY1R
SCHEMBL6840005 0.86 ADORA3 (0.35) ADORA3TLR7NPY1RRXRARXRB
SCHEMBL6840151 0.85 HTR4 (0.41) TLR7NPY1RHTR4
SCHEMBL6838070 0.85 NPY1R (0.37) ADORA3TLR7NPY1R

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-20040054182-A1 1h-imidazopyridine derivatives HOKURIKU SEIYAKU CO., LTD. (JP) 2004-03-18 US disclosed
EP-1256582-A1 1H-IMIDAZOPYRIDINE DERIVATIVES HOKURIKU SEIYAKU CO., LTD. (JP) 2002-11-13 EP 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-20040054182-A1 1h-imidazopyridine derivatives IL2, IL1A, IL4 ADORA3 3201/4885TLR7 964/4885USP2 4185/4885

“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.