SCHEMBL4184834

SCHEMBL4184834

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

nearest known ligand 0.39

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
GCGR P47871 11/20 0.39
GIPR P48546 9/20 0.39
HDAC1 Q13547 1/20 0.37
MEN1 O00255 2/20 0.37
KMT2A Q03164 2/20 0.37
KDM1A O60341 1/20 0.36
RXFP1 Q9HBX9 1/20 0.36
NR1I3 Q14994 1/20 0.36
TP53 P04637 1/20 0.35
CYP1A2 P05177 1/20 0.35
CYP3A4 P08684 1/20 0.35
GAA P10253 1/20 0.35
CYP2C9 P11712 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
SCHEMBL13653122 0.93 GCGR (0.37) GCGRGIPRHDAC1MEN1KMT2A
SCHEMBL13653112 0.88 GCGR (0.40) GCGRGIPRHDAC1MEN1KMT2A
SCHEMBL13653127 0.86 KDM1A (0.40) GCGRGIPRMEN1KMT2AKDM1A
SCHEMBL13653115 0.85 APEX1 (0.41) GCGRGIPRMEN1KMT2ATP53
SCHEMBL4189862 0.84 HDAC1 (0.46) HDAC1KDM1A
SCHEMBL13653109 0.81 PDE4A (0.39) HDAC1MEN1KMT2ARXFP1
SCHEMBL4189530 0.81 KMT2A (0.41) GCGRGIPRMEN1KMT2ATP53
SCHEMBL13653102 0.81 MEN1 (0.42) HDAC1MEN1KMT2ARXFP1
SCHEMBL4185804 0.80 PDE4A (0.44) MEN1KMT2ARXFP1
SCHEMBL13653136 0.78 CA12 (0.45) MEN1KMT2A

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-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 GCGR 3989/4885GIPR 869/4885HDAC1 579/4885

“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.