SCHEMBL382374

SCHEMBL382374

CCOc1ccc(C(NC(=O)OC(C)(C)C)C2CCNCC2)cc1

nearest known ligand 0.44

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
HPGD P15428 1/20 0.44
LMNA P02545 1/20 0.44
ACACB O00763 8/20 0.42
SMYD3 Q9H7B4 3/20 0.41
MMP13 P45452 1/20 0.39
SLC6A2 P23975 1/20 0.39
SLC6A4 P31645 1/20 0.39
SLC6A3 Q01959 1/20 0.39
CNR2 P34972 1/20 0.38
MEN1 O00255 1/20 0.38
CYP1A2 P05177 1/20 0.38
CYP3A4 P08684 1/20 0.38
GAA P10253 1/20 0.38
CYP2D6 P10635 1/20 0.38
CYP2C9 P11712 1/20 0.38
CYP2C19 P33261 1/20 0.38
KMT2A Q03164 1/20 0.38
ITGB3 P05106 1/20 0.38
ITGA2B P08514 1/20 0.38

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
SCHEMBL16394313 0.84 AAK1 (0.45) SMYD3
SCHEMBL5653707 0.84 SMYD3 (0.44) SMYD3SLC6A2SLC6A4SLC6A3
SCHEMBL4116055 0.83 SMYD3 (0.53) SMYD3MEN1KMT2A
SCHEMBL948775 0.82 PDE2A (0.47) SMYD3SLC6A2SLC6A4
SCHEMBL5652485 0.80 SLC6A3 (0.43) LMNASMYD3SLC6A2SLC6A4SLC6A3
SCHEMBL13476449 0.78 SLC6A2 (0.46) SMYD3MMP13SLC6A2SLC6A4SLC6A3
SCHEMBL382534 0.78 HPGD (0.41) HPGDLMNAACACBSLC6A2SLC6A4
SCHEMBL4715530 0.77 SMYD3 (0.46) SMYD3SLC6A2SLC6A4SLC6A3CYP2D6
SCHEMBL4715527 0.77 SMYD3 (0.46) SMYD3SLC6A2SLC6A4SLC6A3CYP2D6
SCHEMBL4696466 0.76 KDM4D (0.45) SMYD3SLC6A2SLC6A4

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
US-9096524-B2 Anthelmintic agents and their use INTERVET INTERNATIONAL B.V. (NL) 2015-08-04 US disclosed
EP-2408742-B1 ANTHELMINTIC AGENTS AND THEIR USE INTERVET INT BV (NL) 2014-09-03 EP disclosed
EP-2408742-A1 ANTHELMINTIC AGENTS AND THEIR USE Intervet International B.V. (NL) 2012-01-25 EP disclosed
US-20110319393-A1 ANTHELMINTIC AGENTS AND THEIR USE INTERVET INTERNATIONAL B.V. (NL) 2011-12-29 US disclosed
WO-2010115688-A1 ANTHELMINTIC AGENTS AND THEIR USE INTERVET INTERNATIONAL B.V. (NL) 2010-10-14 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-20110319393-A1 ANTHELMINTIC AGENTS AND THEIR USE ACHE, ABCB11, MPO HPGD 1189/4885LMNA 3826/4885ACACB 1740/4885

“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.