SCHEMBL4183093

SCHEMBL4183093

Cc1ccc(NC(=O)NC2CCc3cc(C(=O)Nc4ccccc4N)ccc32)cc1C

nearest known ligand 0.47

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
HDAC3 O15379 5/20 0.47
HDAC1 Q13547 4/20 0.47
HDAC2 Q92769 4/20 0.47
ALDH1A1 P00352 2/20 0.45
HDAC4 P56524 2/20 0.45
HDAC7 Q8WUI4 2/20 0.45
HDAC10 Q969S8 2/20 0.45
HDAC11 Q96DB2 2/20 0.45
HDAC8 Q9BY41 2/20 0.45
HDAC6 Q9UBN7 2/20 0.45
HDAC9 Q9UKV0 2/20 0.45
HDAC5 Q9UQL6 2/20 0.45
TRPV1 Q8NER1 7/20 0.44
KMT2A Q03164 5/20 0.44
NPC1 O15118 3/20 0.43
RAB9A P51151 2/20 0.43
MEN1 O00255 2/20 0.42
MAPT P10636 1/20 0.41
EPHA2 P29317 1/20 0.41

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
SCHEMBL4182629 0.93 HDAC1 (0.46) HDAC3HDAC1HDAC2ALDH1A1HDAC4
SCHEMBL4195670 0.91 HDAC1 (0.50) HDAC3HDAC1HDAC2ALDH1A1HDAC4
SCHEMBL4189678 0.90 TRPV1 (0.49) HDAC3HDAC1HDAC2ALDH1A1HDAC4
SCHEMBL4193646 0.89 ALDH1A1 (0.48) HDAC3HDAC1HDAC2ALDH1A1HDAC4
SCHEMBL4183959 0.89 TRPV1 (0.49) HDAC3HDAC1HDAC2HDAC4HDAC7
SCHEMBL4190602 0.88 HDAC1 (0.54) HDAC3HDAC1HDAC2ALDH1A1HDAC4
SCHEMBL4197796 0.88 HDAC3 (0.50) HDAC3HDAC1HDAC2ALDH1A1HDAC4
SCHEMBL4188146 0.87 LMNA (0.54) HDAC3HDAC1HDAC2HDAC4HDAC7
SCHEMBL13653256 0.87 HDAC1 (0.50) HDAC3HDAC1HDAC2HDAC4HDAC7
SCHEMBL4184489 0.86 HDAC1 (0.59) HDAC3HDAC1HDAC2ALDH1A1HDAC4

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 3 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

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 HDAC3 1045/4885HDAC1 579/4885HDAC2 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.