SCHEMBL5279015

SCHEMBL5279015

Cn1c(CNC(=O)N2CC(CCCCNC(=O)COCc3ccc(F)cc3)C2)nc2ccccc21

nearest known ligand 0.43

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
GAA P10253 2/20 0.43
MAPT P10636 1/20 0.42
PKM P14618 1/20 0.41
NPC1 O15118 2/20 0.41
RAB9A P51151 2/20 0.41
ALDH1A1 P00352 2/20 0.40
POLB P06746 1/20 0.40
CHRNA7 P36544 1/20 0.39
TSHR P16473 1/20 0.39
LMNA P02545 2/20 0.38
HTT P42858 1/20 0.38
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
RECQL P46063 1/20 0.37
TP53 P04637 1/20 0.37
HDAC1 Q13547 1/20 0.37

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
SCHEMBL5281998 0.94 POLB (0.41) GAAMAPTPKMNPC1RAB9A
SCHEMBL5491829 0.87 MAPT (0.45) GAAMAPTPKMNPC1RAB9A
SCHEMBL5278888 0.82 GAA (0.56) GAAMAPTPKMNPC1RAB9A
SCHEMBL5275770 0.76 MEN1 (0.41) POLBMEN1KMT2A
SCHEMBL5289399 0.76 LMNA (0.47) GAAMAPTPKMNPC1RAB9A
SCHEMBL5287840 0.74 NAMPT (0.41) RAB9AHDAC1
SCHEMBL5280809 0.73 SIRT1 (0.47) GAAMAPTPOLBMEN1KMT2A
SCHEMBL5284035 0.73 GAA (0.48) GAAMAPTRAB9AALDH1A1POLB
SCHEMBL5280748 0.70 ALDH1A1 (0.50) GAAALDH1A1POLBTSHRLMNA
SCHEMBL5279858 0.70 GPR119 (0.44)

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 6 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 claimed
US-20060264415-A1 Inhibitors of histone deacetylase METHYLGENE INC. 2006-11-23 US claimed
WO-2006102760-A1 INHIBITORS OF HISTONE DEACETYLASE METHYLGENE INC. (CA) 2006-10-05 WO claimed
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 GAA 569/4885MAPT 3848/4885PKM 2287/4885

“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.