SCHEMBL4183198

SCHEMBL4183198

CCN(C(=O)NCCc1ccccc1)C1CCc2cc(C(=O)Nc3ccccc3N)ccc21

nearest known ligand 0.43

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
HDAC1 Q13547 14/20 0.43
HDAC3 O15379 11/20 0.43
HDAC2 Q92769 10/20 0.43
HDAC4 P56524 9/20 0.43
HDAC7 Q8WUI4 9/20 0.43
HDAC10 Q969S8 9/20 0.43
HDAC11 Q96DB2 9/20 0.43
HDAC8 Q9BY41 9/20 0.43
HDAC6 Q9UBN7 9/20 0.43
HDAC9 Q9UKV0 9/20 0.43
HDAC5 Q9UQL6 9/20 0.43
MAPK14 Q16539 1/20 0.42
NCOR2 Q9Y618 1/20 0.40
LMNA P02545 1/20 0.39
MAPT P10636 1/20 0.39
KDM4E B2RXH2 1/20 0.39
ALDH1A1 P00352 1/20 0.39
SMN1; SMN2 Q16637 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
SCHEMBL4195314 0.91 MAPT (0.42) LMNAMAPTKDM4EALDH1A1SMN1; SMN2
SCHEMBL4193470 0.91 HDAC1 (0.48) HDAC1HDAC3HDAC2HDAC4HDAC7
SCHEMBL13653188 0.89 HDAC1 (0.43) HDAC1HDAC3HDAC2HDAC4HDAC7
SCHEMBL4190646 0.87 HDAC1 (0.48) HDAC1HDAC3HDAC2HDAC4HDAC7
SCHEMBL4189862 0.86 HDAC1 (0.46) HDAC1HDAC3HDAC2HDAC4HDAC7
SCHEMBL13653112 0.86 GCGR (0.40) HDAC1LMNAMAPTKDM4EALDH1A1
SCHEMBL4186733 0.86 HDAC3 (0.45) HDAC1HDAC3HDAC2HDAC4HDAC7
SCHEMBL13653189 0.85 HDAC1 (0.45) HDAC1HDAC3HDAC2HDAC4HDAC7
SCHEMBL4192728 0.85 HDAC1 (0.45) HDAC1HDAC3HDAC2HDAC4HDAC7
SCHEMBL27688294 0.84 MEN1 (0.39) LMNAMAPTKDM4EALDH1A1SMN1; SMN2

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 5 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
US-20090247590-A1 Indane amides BAYER PHARMACEUTICLAS CORPORATION (US) 2009-10-01 US disclosed
EP-1802577-A1 INDANE AMIDES WITH ANTIPROLIFERATIVE ACTIVITY Bayer Pharmaceuticals Corporation (US) 2007-07-04 EP disclosed
WO-2006062580-A1 INDANE AMIDES WITH ANTIPROLIFERATIVE ACTIVITY BAYER PHARMACEUTICALS CORPORATION (US) 2006-06-15 WO 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 HDAC1 579/4885HDAC3 1045/4885HDAC2 641/4885

“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.