SCHEMBL4580491

SCHEMBL4580491

CC(=O)Oc1ccc(C(=O)N(N)c2cccc(-c3ccc(F)nc3)c2)cc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.44
GAA P10253 1/20 0.44
GFER P55789 1/20 0.43
MAPT P10636 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
HPGD P15428 1/20 0.38
POLB P06746 1/20 0.38
HSD17B10 Q99714 1/20 0.38
CTSD P07339 1/20 0.36
BACE1 P56817 1/20 0.36
ELANE P08246 1/20 0.36
NPC1 O15118 1/20 0.35
TP53 P04637 1/20 0.35
PKM P14618 1/20 0.35
RAB9A P51151 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
F9 P00740 1/20 0.35
HSD17B1 P14061 1/20 0.35
HSD17B2 P37059 1/20 0.35
CHEK2 O96017 2/20 0.34

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
SCHEMBL4579942 0.78 LMNA (0.43) LMNAGAAGFERMAPTTDP1
SCHEMBL4579927 0.76 BCHE (0.43) SMN1; SMN2
SCHEMBL1066509 0.75 HDAC3 (0.41) LMNAGAAGFERMAPTTDP1
SCHEMBL4580321 0.74 GFER (0.40) LMNAGAAGFERMAPTTDP1
SCHEMBL4578367 0.72 GFER (0.39) LMNAGAAGFERMAPTTDP1
SCHEMBL4578647 0.72 HDAC2 (0.52) MEN1KMT2A
SCHEMBL22801121 0.69 MAP4K4 (0.57) CHEK2FYN
SCHEMBL27702812 0.69 LMNA (0.65) LMNAGAAGFERMAPTTDP1
SCHEMBL7407630 0.68 ALDH1A1 (0.49) LMNAGAAMAPTHPGDPOLB
SCHEMBL4578184 0.66 MEN1 (0.45) LMNAGAAGFERMAPTTDP1

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
EP-2007720-B1 BENZAMIDE DERIVATIVES AS INHIBITORS OF HISTONE DEACETYLASE METHYLGENE INC (CA) 2013-12-25 EP disclosed
US-8598168-B2 Inhibitors of histone deacetylase METHYLGENE INC. (CA) 2013-12-03 US disclosed
EP-2007720-A1 BENZAMIDE DERIVATIVES AS INHIBITORS OF HISTONE DEACETYLASE Methylgene, Inc. (CA) 2008-12-31 EP disclosed
US-20080132503-A1 Inhibitors of Histone Deacetylase METHYLGENE INC. (CA) 2008-06-05 US disclosed
WO-2007118137-A1 BENZAMIDE DERIVATIVES AS INHIBITORS OF HISTONE DEACETYLASE METHYLGENE INC. (CA) 2007-10-18 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-20080132503-A1 Inhibitors of Histone Deacetylase HDAC1, HDAC5, HDAC3 LMNA 1922/4885GAA 210/4885GFER 3966/4885

“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.