SCHEMBL4885893

SCHEMBL4885893

Cc1cn2cc(-n3ccccc3=O)cc(OCc3ccc(F)cc3)c2n1

nearest known ligand 0.52

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 5/20 0.52
CYP2C9 P11712 5/20 0.52
MCHR1 Q99705 7/20 0.43
LMNA P02545 1/20 0.42
POLB P06746 1/20 0.42
MAPT P10636 1/20 0.42
STAT3 P40763 1/20 0.42
HTT P42858 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
MAPK14 Q16539 3/20 0.40
GRM5 P41594 1/20 0.39
CYP1A2 P05177 1/20 0.39
CYP2D6 P10635 1/20 0.39

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
SCHEMBL4882382 0.89 CYP3A4 (0.51) CYP3A4CYP2C9MCHR1SMN1; SMN2GRM5
SCHEMBL4889001 0.85 CYP3A4 (0.72) CYP3A4CYP2C9MCHR1LMNAPOLB
SCHEMBL4885288 0.83 CYP3A4 (0.73) CYP3A4CYP2C9MCHR1CYP1A2CYP2D6
SCHEMBL2191140 0.78 MEN1 (0.51) CYP3A4CYP2C9LMNAPOLBMAPT
SCHEMBL4878917 0.76 CYP3A4 (0.77) CYP3A4CYP2C9MCHR1MEN1KMT2A
SCHEMBL4888752 0.75 CYP3A4 (0.42) CYP3A4CYP2C9MCHR1POLBMAPT
SCHEMBL4886747 0.74 CYP3A4 (0.71) CYP3A4CYP2C9MCHR1GRM5CYP1A2
SCHEMBL14021269 0.73 CYP3A4 (0.44) CYP3A4CYP2C9MCHR1LMNACYP1A2
SCHEMBL14021374 0.73 CYP3A4 (0.85) CYP3A4CYP2C9MCHR1CYP1A2CYP2D6
SCHEMBL4884572 0.73 CYP3A4 (0.58) CYP3A4CYP2C9MCHR1GRM5CYP1A2

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-20080255358-A1 Derivatives of Imidazo [1,2-A] Pyridine Useful as Medicaments For Treating Gastrointestinal Diseases GLAXO GROUP LIMITED (GB) 2008-10-16 US claimed
US-20080255358-A1 Derivatives of Imidazo [1,2-A] Pyridine Useful as Medicaments For Treating Gastrointestinal Diseases GLAXO GROUP LIMITED (GB) 2008-10-16 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-20080255358-A1 Derivatives of Imidazo [1,2-A] Pyridine Useful as Medicaments For Treating Gastrointestinal Diseases ALPI, PYGL, PPIP5K2 CYP3A4 215/4885CYP2C9 1357/4885MCHR1 3902/4885

“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.