SCHEMBL16125422

SCHEMBL16125422

COC(=O)c1ccc2c(cnn2Cc2ccc(-c3ccccc3C(=O)OC(C)(C)C)cc2)c1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ AGTR1 P30556 1/20 0.44
▸ AGTR2 P50052 1/20 0.44
▸ PPARG P37231 3/20 0.42
▸ ACHE P22303 1/20 0.42
▸ MEN1 O00255 2/20 0.41
▸ KMT2A Q03164 2/20 0.41
▸ BRS3 P32247 2/20 0.41
▸ SLC6A4 P31645 2/20 0.40
▸ SLC6A3 Q01959 2/20 0.40
▸ EGFR P00533 1/20 0.39
▸ ERBB2 P04626 1/20 0.39
▸ ALOX5AP P20292 1/20 0.39
▸ DRD2 P14416 1/20 0.39
▸ TBXA2R P21731 1/20 0.39
▸ HDAC1 Q13547 1/20 0.39
▸ HDAC6 Q9UBN7 1/20 0.39
▸ POLB P06746 1/20 0.39
▸ EPHX2 P34913 2/20 0.39
▸ SMO Q99835 1/20 0.39
▸ SLC6A2 P23975 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
SCHEMBL14977445 0.92 PPARG (0.47) PPARGACHEEGFRERBB2
SCHEMBL16125416 0.88 PPARG (0.51) PPARGEPHX2
SCHEMBL16125409 0.85 PPARG (0.60) AGTR1PPARG
SCHEMBL28559641 0.84 HCAR3 (0.50) PPARGACHEMEN1KMT2ASLC6A4
SCHEMBL16125430 0.83 PPARG (0.60) PPARG
SCHEMBL25413010 0.83 MEN1 (0.52) MEN1KMT2AEGFRERBB2DRD2
SCHEMBL16125424 0.83 PPARG (0.47) PPARGACHEMEN1KMT2APOLB
SCHEMBL14121297 0.83 PPARG (0.56) PPARGACHEDRD2TBXA2RHDAC1
SCHEMBL16125427 0.82 PPARG (0.45) AGTR1AGTR2PPARGACHEMEN1
SCHEMBL16125443 0.81 PPARG (0.62) PPARG

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-20140288090-A1 N-ARYLYLMETHYLINDAZOLE MODULATORS OF PPARG SCRIPPS RESEARCH INSTITUTE, THE 2014-09-25 — — US disclosed
US-20140288090-A1 N-ARYLYLMETHYLINDAZOLE MODULATORS OF PPARG SCRIPPS RESEARCH INSTITUTE, THE 2014-09-25 — — 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-20140288090-A1 N-ARYLYLMETHYLINDAZOLE MODULATORS OF PPARG CDK5, CDK5R1, PPARG AGTR1 1619/4885AGTR2 1891/4885PPARG 3/4885

“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.

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