SCHEMBL5280853

SCHEMBL5280853

COC(=O)c1ccc(CCNC(=O)COCc2ccc(F)cc2)cc1

nearest known ligand 0.68

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.68
HPGD P15428 1/20 0.52
MEN1 O00255 2/20 0.51
KMT2A Q03164 2/20 0.51
MAPK1 P28482 1/20 0.51
SMN1; SMN2 Q16637 1/20 0.50
ALDH1A1 P00352 1/20 0.50
GAA P10253 1/20 0.50
MAPT P10636 2/20 0.48
POLB P06746 1/20 0.48
MGLL Q99685 1/20 0.48
KDM4E B2RXH2 1/20 0.47
EPHX2 P34913 1/20 0.46

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
SCHEMBL6037974 0.84 LMNA (0.59) LMNAHPGDKMT2AALDH1A1GAA
SCHEMBL5276141 0.82 FFAR1 (0.52) LMNAMEN1KMT2AMAPK1SMN1; SMN2
SCHEMBL6037885 0.81 LMNA (0.55) LMNAHPGDMEN1KMT2AALDH1A1
SCHEMBL15437144 0.79 MEN1 (0.65) LMNAHPGDMEN1KMT2AMAPK1
SCHEMBL12294453 0.79 MEN1 (0.65) LMNAHPGDMEN1KMT2AMAPK1
SCHEMBL6038200 0.79 CA1 (0.71) LMNAMEN1KMT2ASMN1; SMN2ALDH1A1
SCHEMBL5281557 0.78 LMNA (0.50) LMNAHPGDKMT2ASMN1; SMN2ALDH1A1
SCHEMBL5325209 0.78 LMNA (0.51) LMNAHPGDMEN1KMT2AALDH1A1
SCHEMBL5282172 0.77 LMNA (0.49) LMNAHPGDKMT2ASMN1; SMN2ALDH1A1
SCHEMBL11253516 0.77 MEN1 (0.63) LMNAMEN1KMT2AMAPK1SMN1; 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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1863804-A1 INHIBITORS OF HISTONE DEACETYLASE Methylgene, Inc. (CA) 2007-12-12 EP disclosed
US-20060264415-A1 Inhibitors of histone deacetylase METHYLGENE INC. 2006-11-23 US disclosed
WO-2006102760-A1 INHIBITORS OF HISTONE DEACETYLASE METHYLGENE INC. (CA) 2006-10-05 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-20060264415-A1 Inhibitors of histone deacetylase HDAC1, HDAC3, HDAC11 LMNA 851/4885HPGD 2248/4885MEN1 2348/4885

“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.