SCHEMBL4568566

SCHEMBL4568566

Cc1cc2c(Cc3cccc(C(=O)O)n3)c(-c3ccccc3)[nH]c2cc1C(F)(F)F

nearest known ligand 0.45

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
MRGPRX4 Q96LA9 1/20 0.40
PPARG P37231 1/20 0.39
ENPP2 Q13822 1/20 0.38

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
SCHEMBL4568461 0.91 MRGPRX4 (0.44) MRGPRX4
SCHEMBL4568565 0.89 MRGPRX4 (0.40) MRGPRX4PPARG
SCHEMBL3706414 0.89 PPARG (0.43) PPARGENPP2
SCHEMBL4568564 0.89 MRGPRX4 (0.44) MRGPRX4
SCHEMBL4568585 0.87 PPARG (0.40) PPARGENPP2
SCHEMBL3714666 0.85 PPARG (0.40) PPARG
SCHEMBL3703812 0.85 ENPP2 (0.43) MRGPRX4PPARGENPP2
SCHEMBL3703871 0.83 PDE10A (0.45) MRGPRX4PPARG
SCHEMBL4568207 0.83 MRGPRX4 (0.46) MRGPRX4
SCHEMBL3705668 0.82 MRGPRX4 (0.43) MRGPRX4PPARG

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-20120122931-A1 INDOLE DERIVATIVE OR PHARMACEUTICALLY ACCEPTABLE SALT THEREOF KISSEI PHARMACEUTICAL CO., LTD. (JP) 2012-05-17 US disclosed
US-20120122931-A1 INDOLE DERIVATIVE OR PHARMACEUTICALLY ACCEPTABLE SALT THEREOF KISSEI PHARMACEUTICAL CO., LTD. (JP) 2012-05-17 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-20120122931-A1 INDOLE DERIVATIVE OR PHARMACEUTICALLY ACCEPTABLE SALT THEREOF PTGER1, CYSLTR1, LTB4R MRGPRX4 273/4885PPARG 500/4885ENPP2 595/4885

“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.