SCHEMBL6833788

SCHEMBL6833788

FC(F)(F)c1nc2cc(Cl)ccc2c2c1nc(-c1ncc[nH]1)n2CCN1CCNCC1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADRB2 P07550 2/20 0.35
NCF1 P14598 2/20 0.35
KMT2A Q03164 2/20 0.34
ATM Q13315 1/20 0.34
CYP1A2 P05177 1/20 0.32
CYP2D6 P10635 1/20 0.32
MEN1 O00255 1/20 0.32
HRH3 Q9Y5N1 3/20 0.32
CYP3A4 P08684 1/20 0.32
CHRM1 P11229 1/20 0.32
DRD3 P35462 1/20 0.32
OPRK1 P41145 1/20 0.32
PDE4D Q08499 1/20 0.32
KCNH2 Q12809 1/20 0.32
PDE3A Q14432 1/20 0.32
SOS1 Q07889 1/20 0.32
KCNK13 Q9HB14 1/20 0.31
RAD52 P43351 1/20 0.31
HTR3E A5X5Y0 1/20 0.31
HTR3B O95264 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
SCHEMBL6840144 0.91 SLC6A2 (0.37) ADRB2NCF1KCNH2
SCHEMBL6838063 0.91 ADRB2 (0.35) ADRB2NCF1KCNH2
SCHEMBL6833773 0.87 NPY1R (0.37) ADRB2NCF1CYP1A2CYP2D6KCNH2
SCHEMBL6838576 0.85 KMT2A (0.33) ADRB2NCF1KMT2AATMCYP1A2
SCHEMBL6837641 0.85 EGFR (0.42) ADRB2KMT2AATMCYP1A2CYP2D6
SCHEMBL6838395 0.85 EIF4EBP1 (0.35) ADRB2NCF1KMT2AATMCYP1A2
SCHEMBL6838090 0.82 EPHA2 (0.34) KCNH2
SCHEMBL6838565 0.82 HTR6 (0.42) ADRB2NCF1KMT2AATMCYP1A2
SCHEMBL6838072 0.82 HRH1 (0.35) ADRB2NCF1KMT2AATMCYP1A2
SCHEMBL6840082 0.82 NCF1 (0.34) NCF1

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 ADRB2 521/4885NCF1 85/4885KMT2A 2512/4885

“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.