SCHEMBL13653115

SCHEMBL13653115

CCN(C1CCc2cc(C(=O)Nc3ccccc3NC(=O)OC(C)(C)C)ccc21)S(=O)(=O)c1ccccc1

nearest known ligand 0.41

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
APEX1 P27695 1/20 0.41
GAA P10253 2/20 0.39
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
CYP3A4 P08684 2/20 0.39
TP53 P04637 1/20 0.39
CYP1A2 P05177 1/20 0.39
CYP2C9 P11712 1/20 0.39
ALDH1A1 P00352 1/20 0.38
SMN1; SMN2 Q16637 2/20 0.38
LMNA P02545 2/20 0.38
TSHR P16473 1/20 0.38
MAPT P10636 1/20 0.38
TAS2R14 Q9NYV8 1/20 0.37
GCGR P47871 3/20 0.37
GIPR P48546 2/20 0.37

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
SCHEMBL4195752 0.89 APEX1 (0.46) APEX1GAAMEN1KMT2ACYP3A4
SCHEMBL4184834 0.85 GCGR (0.39) GAAMEN1KMT2ACYP3A4TP53
SCHEMBL4186907 0.85 CA12 (0.50) APEX1GAAMEN1KMT2ACYP3A4
SCHEMBL13653122 0.84 GCGR (0.37) MEN1KMT2AGCGRGIPR
SCHEMBL4195612 0.81 CA12 (0.45) APEX1MEN1KMT2AALDH1A1SMN1; SMN2
SCHEMBL4174953 0.80 CA12 (0.50) APEX1GAATP53ALDH1A1MAPT
SCHEMBL4185822 0.79 HDAC1 (0.50) MAPTTAS2R14
SCHEMBL13653112 0.79 GCGR (0.40) MEN1KMT2AALDH1A1SMN1; SMN2LMNA
SCHEMBL4187089 0.79 CA12 (0.49) GAAALDH1A1LMNA
SCHEMBL4197907 0.79 HDAC1 (0.45) MEN1KMT2ASMN1; SMN2MAPT

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-20090247590-A1 Indane amides BAYER PHARMACEUTICLAS CORPORATION (US) 2009-10-01 US disclosed
US-20090247590-A1 Indane amides BAYER PHARMACEUTICLAS CORPORATION (US) 2009-10-01 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-20090247590-A1 Indane amides MKI67, PPIP5K2, CCNA1 APEX1 732/4885GAA 1331/4885MEN1 612/4885

“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.