SCHEMBL5325209

SCHEMBL5325209

O=C(COCc1ccc(F)cc1)NCCCc1ccc(O)cc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.51
MEN1 O00255 1/20 0.48
KMT2A Q03164 1/20 0.48
TRPV1 Q8NER1 1/20 0.48
RAB9A P51151 2/20 0.47
NPC1 O15118 1/20 0.47
AKR1B10 O60218 1/20 0.46
AKR1A1 P14550 1/20 0.46
AKR1B1 P15121 1/20 0.46
CBR1 P16152 1/20 0.46
AKR1C4 P17516 1/20 0.46
AKR1C3 P42330 1/20 0.46
AKR1C2 P52895 1/20 0.46
AKR1C1 Q04828 1/20 0.46
HPGD P15428 1/20 0.46
MAPT P10636 1/20 0.45
ALDH1A1 P00352 1/20 0.44
GAA P10253 1/20 0.44
ESRRG P62508 1/20 0.44
EPHX2 P34913 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
SCHEMBL6037915 0.91 LMNA (0.50) LMNAMEN1KMT2ARAB9ANPC1
SCHEMBL6038163 0.90 LMNA (0.49) LMNAMEN1KMT2ARAB9ANPC1
SCHEMBL6038064 0.90 LMNA (0.49) LMNAMEN1KMT2ARAB9ANPC1
SCHEMBL6037952 0.88 LMNA (0.48) LMNAMEN1KMT2ARAB9ANPC1
SCHEMBL5277774 0.87 LMNA (0.51) LMNAMEN1KMT2ARAB9ANPC1
SCHEMBL6037960 0.85 CA1 (0.61) LMNAALDH1A1
SCHEMBL6037902 0.85 RAB9A (0.50) LMNAKMT2ARAB9AHPGDMAPT
SCHEMBL5280483 0.82 RAB9A (0.48) LMNAKMT2ARAB9AHPGDMAPT
SCHEMBL6037974 0.82 LMNA (0.59) LMNAKMT2AHPGDALDH1A1GAA
SCHEMBL6037906 0.81 CA1 (0.45) LMNAMEN1KMT2ARAB9AHPGD

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 851/4885MEN1 2348/4885KMT2A 30/4885

“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.