SCHEMBL504356

SCHEMBL504356

CC(C)Oc1ccc(Oc2ccc3c(c2)c(C(=O)O)c(CC(=O)O)n3-c2ccc(Oc3ccc(OC(F)(F)F)cc3)cc2)cc1

nearest known ligand 0.42

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
PPARG P37231 7/20 0.42
PPARA Q07869 4/20 0.42
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
PTGES O14684 3/20 0.39
KDM4E B2RXH2 2/20 0.38
USP14 P54578 1/20 0.37
PLA2G4A P47712 2/20 0.36
GAA P10253 1/20 0.36
FFAR4 Q5NUL3 1/20 0.36
BCL2 P10415 1/20 0.36
MDM2 Q00987 1/20 0.36
MCL1 Q07820 1/20 0.36
THRB P10828 2/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
TP53 P04637 1/20 0.35
MAPT P10636 1/20 0.35
PPARD Q03181 1/20 0.35

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
SCHEMBL361319 1.00 PPARG (0.42) PPARGPPARAMEN1KMT2APTGES
SCHEMBL360369 0.94 PPARG (0.47) PPARGPPARAMEN1KMT2APTGES
SCHEMBL334349 0.91 PPARG (0.44) PPARGPPARAMEN1KMT2APTGES
SCHEMBL10076916 0.89 PPARG (0.47) PPARGPPARAMEN1KMT2AKDM4E
SCHEMBL333231 0.89 MEN1 (0.48) MEN1KMT2APTGESKDM4EUSP14
SCHEMBL503634 0.88 MEN1 (0.38) PPARGPPARAMEN1KMT2APTGES
SCHEMBL334350 0.88 PTGES (0.52) PPARGPPARAMEN1KMT2APTGES
SCHEMBL333774 0.88 PPARG (0.46) PPARGPPARAMEN1KMT2APLA2G4A
SCHEMBL334235 0.88 BCL2 (0.42) MEN1KMT2APTGESKDM4EUSP14
SCHEMBL333611 0.88 PPARG (0.47) PPARGPPARAMEN1KMT2APTGES

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-20120029016-A1 Indoles Useful in the Treatment of Inflammation BIOLIPOX AB (SW) 2012-02-02 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-20120029016-A1 Indoles Useful in the Treatment of Inflammation LTC4S, LTB4R2, LTB4R PPARG 3260/4885PPARA 1860/4885MEN1 2934/4885

“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.