SCHEMBL352556

SCHEMBL352556

CNC(=O)CCC(=O)c1cccs1

nearest known ligand 0.72

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.72
LMNA P02545 3/20 0.72
POLB P06746 3/20 0.72
MEN1 O00255 3/20 0.72
KMT2A Q03164 3/20 0.72
NPC1 O15118 2/20 0.72
RAB9A P51151 2/20 0.72
L3MBTL1 Q9Y468 3/20 0.61
HPGD P15428 2/20 0.61
HDAC1 Q13547 1/20 0.58
CTNNB1 P35222 1/20 0.58
WNT3A P56704 1/20 0.58
GAA P10253 1/20 0.57
KDM4E B2RXH2 1/20 0.56

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
SCHEMBL1200312 0.86 LMNA (0.61) ALDH1A1LMNAPOLBMEN1KMT2A
SCHEMBL2216212 0.85 ALDH1A1 (1.00) ALDH1A1LMNAPOLBMEN1KMT2A
SCHEMBL11542756 0.84 HDAC1 (0.79) ALDH1A1LMNAPOLBMEN1KMT2A
SCHEMBL2516127 0.81 LMNA (0.75) ALDH1A1LMNAPOLBMEN1KMT2A
SCHEMBL170394 0.81 ALDH1A1 (0.69) ALDH1A1LMNAPOLBMEN1KMT2A
SCHEMBL18755474 0.80 ALDH1A1 (0.81) ALDH1A1LMNAPOLBMEN1KMT2A
Hydrochloric Acid SCHEMBL992300 0.79 ALDH1A1 (0.67) ALDH1A1LMNAPOLBMEN1KMT2A
SCHEMBL20620075 0.79 ALDH1A1 (0.76) ALDH1A1LMNAPOLBMEN1KMT2A
SCHEMBL10352206 0.78 ALDH1A1 (0.77) ALDH1A1LMNAPOLBMEN1KMT2A
SCHEMBL759462 0.78 ALDH1A1 (0.84) ALDH1A1LMNAPOLBMEN1KMT2A

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8148380-B2 Antibacterial amide and sulfonamide substituted heterocyclic urea compounds CRESTONE, INC. (US) 2012-04-03 US disclosed
US-20120015941-A1 Antibacterial Amide and Sulfonamide Substituted Heterocyclic Urea Compounds CRESTONE, INC. (US) 2012-01-19 US 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-20120015941-A1 Antibacterial Amide and Sulfonamide Substituted Heterocyclic Urea Compounds NAAA, AADAC, RPSA ALDH1A1 2806/4885LMNA 4293/4885POLB 1884/4885

“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.