SCHEMBL4878638

SCHEMBL4878638

C=Cc1c(C)nc2c(OC(=O)C(F)(F)F)cc(-n3ccccc3=O)cn12

nearest known ligand 0.46

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 12/20 0.46
CYP2C9 P11712 11/20 0.46
CYP1A2 P05177 2/20 0.38
CYP2D6 P10635 1/20 0.38
F10 P00742 1/20 0.31
ELANE P08246 1/20 0.30
MEN1 O00255 1/20 0.30
MAPT P10636 1/20 0.30
CYP2C19 P33261 1/20 0.30
KMT2A Q03164 1/20 0.30

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
Trifluoroacetic Acid SCHEMBL4878633 0.83 CYP3A4 (0.43) CYP3A4CYP2C9CYP1A2CYP2D6
SCHEMBL4888752 0.80 CYP3A4 (0.42) CYP3A4CYP2C9CYP1A2CYP2D6F10
SCHEMBL14021275 0.80 CYP3A4 (0.46) CYP3A4CYP2C9CYP1A2CYP2D6KMT2A
SCHEMBL4885850 0.77 CYP3A4 (0.77) CYP3A4CYP2C9CYP1A2CYP2D6CYP2C19
SCHEMBL4888544 0.75 CYP3A4 (0.55) CYP3A4CYP2C9CYP1A2CYP2D6MEN1
SCHEMBL4887980 0.69 CYP3A4 (0.79) CYP3A4CYP2C9CYP1A2CYP2D6CYP2C19
SCHEMBL12996941 0.67 CYP3A4 (0.67) CYP3A4CYP2C9CYP1A2CYP2D6CYP2C19
SCHEMBL4878917 0.65 CYP3A4 (0.77) CYP3A4CYP2C9CYP1A2CYP2D6MEN1
SCHEMBL4881228 0.65 CYP3A4 (0.61) CYP3A4CYP2C9CYP1A2CYP2D6CYP2C19
SCHEMBL4889001 0.64 CYP3A4 (0.72) CYP3A4CYP2C9CYP1A2CYP2D6MAPT

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-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 1357/4885CYP1A2 149/4885

“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.