SCHEMBL4935440

SCHEMBL4935440

N[C@@H](CCC(=O)NC1CCCCC1)C(=O)NO

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HDAC3 O15379 2/20 0.53
HDAC1 Q13547 2/20 0.53
HDAC2 Q92769 2/20 0.53
HDAC10 Q969S8 2/20 0.53
HDAC11 Q96DB2 2/20 0.53
HDAC8 Q9BY41 2/20 0.53
HDAC6 Q9UBN7 2/20 0.53
NCOR2 Q9Y618 1/20 0.53
SMN1; SMN2 Q16637 3/20 0.51
ALDH1A1 P00352 2/20 0.51
HPGD P15428 2/20 0.50
CASR P41180 1/20 0.45
EPHX1 P07099 6/20 0.45
KMT2A Q03164 1/20 0.45
DPP4 P27487 1/20 0.45
DPP8 Q6V1X1 1/20 0.45
EPHX2 P34913 2/20 0.44
NPC1 O15118 1/20 0.44
RAB9A P51151 1/20 0.44
KDM4E B2RXH2 1/20 0.44

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
SCHEMBL4935449 1.00 HDAC3 (0.53) HDAC3HDAC1HDAC2HDAC10HDAC11
SCHEMBL4935380 0.91 HDAC1 (0.58) HDAC3HDAC1HDAC2HDAC10HDAC11
SCHEMBL24322687 0.90 SMN1; SMN2 (0.55) HDAC3HDAC1HDAC2HDAC10HDAC11
SCHEMBL1768546 0.84 SMN1; SMN2 (0.61) HDAC3HDAC1HDAC2HDAC10HDAC11
SCHEMBL1768548 0.84 SMN1; SMN2 (0.61) HDAC3HDAC1HDAC2HDAC10HDAC11
SCHEMBL1768585 0.82 SMN1; SMN2 (0.59) HDAC3HDAC1HDAC2HDAC10HDAC11
SCHEMBL1768587 0.82 SMN1; SMN2 (0.59) HDAC3HDAC1HDAC2HDAC10HDAC11
SCHEMBL10132091 0.82 LMNA (0.56) HDAC3HDAC1HDAC2HDAC10HDAC11
SCHEMBL10885389 0.78 BLM (0.52) SMN1; SMN2ALDH1A1HPGDCASREPHX1
SCHEMBL10885385 0.78 BLM (0.52) SMN1; SMN2ALDH1A1HPGDCASREPHX1

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-20080132539-A1 Hydroxamic Acid Derivative And Age Generation Inhibitor Containing The Derivative KUREHA CORPORATION (JP) 2008-06-05 US disclosed
EP-1707560-A1 HYDROXAMIC ACID DERIVATIVE AND AGE GENERATION INHIBITOR CONTAINING THE DERIVATIVE Kureha Corporation (JP) 2006-10-04 EP 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-20080132539-A1 Hydroxamic Acid Derivative And Age Generation Inhibitor Containing The Derivative HDAC5, HDAC1, HDAC9 HDAC3 17/4885HDAC1 2/4885HDAC2 12/4885

“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.