SCHEMBL5024015

SCHEMBL5024015

O=c1ccn(CC[S])c(=O)[nH]1

nearest known ligand 0.59

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.53
DUT P33316 10/20 0.50
CRBN Q96SW2 3/20 0.50
PKM P14618 1/20 0.49
ALDH1A1 P00352 1/20 0.45
LMNA P02545 1/20 0.45

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
SCHEMBL5016827 0.89 DUT (0.55) L3MBTL1DUTCRBNPKM
SCHEMBL4348697 0.87 L3MBTL1 (0.59) L3MBTL1DUTCRBNPKMALDH1A1
SCHEMBL14861415 0.82 L3MBTL1 (0.54) L3MBTL1DUTCRBNPKMALDH1A1
SCHEMBL2983407 0.80 ALDH1A1 (0.57) L3MBTL1DUTCRBNPKMALDH1A1
SCHEMBL3235869 0.80 L3MBTL1 (0.53) L3MBTL1DUTCRBNPKMALDH1A1
SCHEMBL4286089 0.80 PKM (0.57) L3MBTL1DUTCRBNPKM
SCHEMBL2990980 0.80 L3MBTL1 (0.53) L3MBTL1DUTCRBNPKMALDH1A1
SCHEMBL10924758 0.79 PKM (0.55) L3MBTL1DUTCRBNPKMALDH1A1
SCHEMBL24263706 0.77 DUT (0.55) L3MBTL1DUTCRBNPKM
SCHEMBL3079985 0.77 DUT (0.56) L3MBTL1DUTCRBNALDH1A1LMNA

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
EP-1313751-B1 NEW MACROLIDES WITH ANTIBACTERIAL ACTIVITY BASILEA PHARMACEUTICA AG (CH) 2008-09-17 EP disclosed
US-6740642-B2 ACTIVE AGAINST GRAM POSITIVE PATHOGENS SUCH AS STAPHYLOCOCCUS AUREUS, STREPTOCOCCUS PNEUMONIAE, GRAM NEGATIVE STRAINS SUCH AS HAEMOPHILUS INFLUENZAE; IMPROVED STABILITY BASILEA PARMACEUTICA AG (CH) 2004-05-25 US disclosed
US-20030199459-A1 Macrolides with antibacterial activity BASILEA PHARMACEUTICA AG, A SWISS COMPANY (CH) 2003-10-23 US disclosed
EP-1313751-A1 NEW MACROLIDES WITH ANTIBACTERIAL ACTIVITY Basilea Pharmaceutica AG (CH) 2003-05-28 EP disclosed
WO-2002016380-A1 NEW MACROLIDES WITH ANTIBACTERIAL ACTIVITY BASILEA PHARMACEUTICA AG (CH) 2002-02-28 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-20030199459-A1 Macrolides with antibacterial activity MRPL21, MRPS22, MRPL12 L3MBTL1 166/4885DUT 1678/4885CRBN 2889/4885

“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.