SCHEMBL13653241

SCHEMBL13653241

Cc1cccc(COC(=O)NC2CCc3cc(C(=O)Nc4ccccc4N)ccc32)c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HDAC2 Q92769 14/20 0.47
HDAC1 Q13547 13/20 0.47
HDAC3 O15379 11/20 0.47
HDAC6 Q9UBN7 7/20 0.43
HDAC4 P56524 6/20 0.43
HDAC7 Q8WUI4 6/20 0.43
HDAC10 Q969S8 6/20 0.43
HDAC11 Q96DB2 6/20 0.43
HDAC8 Q9BY41 6/20 0.43
HDAC9 Q9UKV0 6/20 0.43
HDAC5 Q9UQL6 6/20 0.43
KDM1A O60341 1/20 0.43
CYP3A4 P08684 1/20 0.43
F3 P13726 1/20 0.43
NCOR2 Q9Y618 1/20 0.43
LMNA P02545 1/20 0.42
NCOR1 O75376 1/20 0.41
TRPV1 Q8NER1 1/20 0.40
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40

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
SCHEMBL13653243 0.92 HDAC1 (0.50) HDAC2HDAC1HDAC3HDAC6HDAC4
SCHEMBL13653201 0.92 HDAC1 (0.56) HDAC2HDAC1HDAC3HDAC6HDAC4
SCHEMBL13653214 0.90 NPC1 (0.49) HDAC2HDAC1HDAC3HDAC6HDAC4
SCHEMBL13653211 0.90 HDAC1 (0.47) HDAC2HDAC1HDAC3HDAC6HDAC4
SCHEMBL24890545 0.87 HDAC1 (0.50) HDAC2HDAC1HDAC3HDAC6HDAC4
SCHEMBL13653246 0.87 HDAC1 (0.53) HDAC2HDAC1HDAC3HDAC6HDAC4
SCHEMBL13653240 0.87 HDAC2 (0.45) HDAC2HDAC1HDAC3HDAC6HDAC4
SCHEMBL13653113 0.86 HDAC1 (0.60) HDAC2HDAC1HDAC3HDAC6HDAC4
SCHEMBL4188376 0.85 TRPV1 (0.47) HDAC2HDAC1HDAC3HDAC6HDAC4
SCHEMBL13653245 0.84 SCN3A (0.48) HDAC2HDAC1HDAC3HDAC6HDAC4

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 HDAC2 641/4885HDAC1 579/4885HDAC3 1045/4885

“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.