SCHEMBL6833774

SCHEMBL6833774

c1ccc(-c2nc3c(-c4cccs4)nc4ccccc4c3n2CCC2CCNCC2)cc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PLAUR Q03405 2/20 0.39
MERTK Q12866 1/20 0.37
ACP1 P24666 2/20 0.37
HDAC3 O15379 2/20 0.36
HDAC1 Q13547 2/20 0.36
HDAC2 Q92769 2/20 0.36
NPY1R P25929 1/20 0.36
CYP2C9 P11712 2/20 0.36
LMNA P02545 2/20 0.36
MEN1 O00255 1/20 0.36
USP2 O75604 1/20 0.36
ALDH1A1 P00352 1/20 0.36
TP53 P04637 1/20 0.36
CYP1A2 P05177 1/20 0.36
CYP3A4 P08684 1/20 0.36
CYP2D6 P10635 1/20 0.36
TSHR P16473 1/20 0.36
CASP1 P29466 1/20 0.36
CYP2C19 P33261 1/20 0.36
CASP7 P55210 1/20 0.36

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
SCHEMBL6838078 0.88 MERTK (0.43) MERTKACP1NPY1RALDH1A1HTR4
SCHEMBL6929021 0.85 KDM4E (0.40) PLAURACP1NPY1RCYP2C9LMNA
SCHEMBL6927683 0.84 NPY1R (0.40) PLAURACP1NPY1RCYP2C9LMNA
SCHEMBL6840109 0.83 KDM4E (0.38) PLAURACP1NPY1RCYP2C9LMNA
SCHEMBL7489996 0.82 NPY1R (0.40) MERTKACP1NPY1RALDH1A1TSHR
SCHEMBL6928192 0.82 HTR4 (0.42) MERTKACP1NPY1RHTR4PDE6D
SCHEMBL6838688 0.81 ALDH1A1 (0.38) MERTKNPY1RLMNAMEN1ALDH1A1
SCHEMBL6929281 0.81 NPY1R (0.40) MERTKACP1HDAC1NPY1RHTR4
SCHEMBL6925914 0.81 NPY1R (0.44) MERTKACP1NPY1RLMNAALDH1A1
SCHEMBL6838557 0.81 MAOB (0.39) MERTKACP1NPY1RHTR4PDE6D

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 PLAUR 3898/4885MERTK 2059/4885ACP1 490/4885

“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.