SCHEMBL4923728

SCHEMBL4923728

CC(C)Cn1nnc(-c2ccc(C(N)=O)cc2)n1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TRPV1 Q8NER1 1/20 0.49
TP53 P04637 2/20 0.49
LMNA P02545 2/20 0.49
USP2 O75604 1/20 0.49
CYP1A2 P05177 1/20 0.49
CYP2C9 P11712 1/20 0.49
ALOX15 P16050 1/20 0.49
CASP3 P42574 1/20 0.49
SENP8 Q96LD8 1/20 0.49
SENP7 Q9BQF6 1/20 0.49
SENP6 Q9GZR1 1/20 0.49
LTA4H P09960 8/20 0.47
GAA P10253 2/20 0.47
MAPT P10636 2/20 0.47
HTT P42858 2/20 0.47
ALDH1A1 P00352 1/20 0.47
HDAC6 Q9UBN7 2/20 0.46
MEN1 O00255 2/20 0.46
KMT2A Q03164 2/20 0.46
SLC6A3 Q01959 3/20 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
SCHEMBL4923738 0.81 LMNA (0.68) TRPV1TP53LMNAUSP2CYP1A2
SCHEMBL4407341 0.78 TRPV1 (0.59) TRPV1CYP1A2ALDH1A1MEN1KMT2A
SCHEMBL4927936 0.76 MKNK1 (0.44) TP53LMNAUSP2CYP1A2CYP2C9
SCHEMBL8848809 0.76 LMNA (0.49) LMNALTA4HALDH1A1MEN1KMT2A
SCHEMBL24948886 0.75 LMNA (0.59) TRPV1TP53LMNAUSP2CYP1A2
SCHEMBL10731851 0.74 LMNA (0.44) TP53LMNAUSP2CYP1A2CYP2C9
SCHEMBL4799195 0.70 TP53 (0.78) TP53LMNAUSP2CYP1A2CYP2C9
SCHEMBL16648468 0.70 LTA4H (0.63) LMNAUSP2LTA4HKMT2ASMN1; SMN2
SCHEMBL4672394 0.70 LMNA (0.47) LMNAUSP2LTA4HGAAHTT
SCHEMBL15748062 0.69 MKNK1 (0.53) TP53USP2MAPTALDH1A1MEN1

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
US-20080207694-A1 Hydroxamates as Histone Deacetylase Inhibitors and Pharmaceutical Formulations Containing Them ROSSI CRISTINA 2008-08-28 US disclosed
EP-1868997-A1 HYDROXAMATES AS HISTONE DEACETYLASE INHIBITORS AND PHARMACEUTICAL FORMULATIONS CONTAINING THEM Menarini International Operations Luxembourg S.A. (LU) 2007-12-26 EP disclosed
WO-2006097460-A1 HYDROXAMATES AS HISTONE DEACETYLASE INHIBITORS AND PHARMACEUTICAL FORMULATIONS CONTAINING THEM MENARINI INTERNATIONAL OPERATIONS LUXEMBOURG S.A. (LU) 2006-09-21 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-20080207694-A1 Hydroxamates as Histone Deacetylase Inhibitors and Pharmaceutical Formulations Containing Them HDAC1, HDAC8, HDAC9 TRPV1 1447/4885TP53 1658/4885LMNA 1681/4885

“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.