SCHEMBL4874794

SCHEMBL4874794

O=S(=O)(Nc1c2c(nn1-c1ccc(Cl)cc1)CSC2)c1ccccc1

nearest known ligand 0.58

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
TP53 P04637 2/20 0.50
ENPP2 Q13822 1/20 0.47
CYP1A2 P05177 1/20 0.47
CYP3A4 P08684 1/20 0.47
GAA P10253 1/20 0.47
CYP2C9 P11712 1/20 0.47
CYP2C19 P33261 1/20 0.47
KMT2A Q03164 2/20 0.46
MAPT P10636 2/20 0.46
POLB P06746 2/20 0.44
LMNA P02545 1/20 0.44
MEN1 O00255 1/20 0.43

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
SCHEMBL14024418 0.89 TSHR (0.54) TP53CYP1A2CYP3A4GAACYP2C9
SCHEMBL4881669 0.84 MAPT (0.51) TP53ENPP2KMT2AMAPTPOLB
SCHEMBL4880737 0.77 TP53 (0.41) TP53ENPP2CYP3A4CYP2C9KMT2A
SCHEMBL4882847 0.75 ENPP2 (0.66) TP53ENPP2KMT2AMAPT
SCHEMBL13235183 0.74 MAPT (0.58) TP53ENPP2KMT2AMAPTPOLB
SCHEMBL4883373 0.73 MAPT (0.59) TP53ENPP2KMT2AMAPT
SCHEMBL4884603 0.73 LMNA (0.71) TP53ENPP2KMT2AMAPTPOLB
SCHEMBL4884595 0.73 LMNA (0.71) TP53ENPP2KMT2AMAPTPOLB
SCHEMBL4875036 0.72 TP53 (0.59) TP53ENPP2KMT2AMAPTPOLB
SCHEMBL15715997 0.70 MAPT (0.69) TP53ENPP2CYP1A2CYP3A4CYP2C9

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-20080249154-A1 Preventive and/or Therapeutic Agent For Disease In Which Mitochondrial Benzodiazephine Receptor Participates ONO PHARMACEUTICAL CO., LTD. (JP) 2008-10-09 US disclosed
EP-1698335-A1 PREVENTIVE AND/OR THERAPEUTIC AGENT FOR DISEASE IN WHICH MITOCHONDRIAL BENZODIAZEPINE RECEPTOR PARTICIPATES ONO PHARMACEUTICAL CO., LTD. (JP) 2006-09-06 EP 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-20080249154-A1 Preventive and/or Therapeutic Agent For Disease In Which Mitochondrial Benzodiazephine Receptor Participates MTNR1A, GSR, NLN TP53 2534/4885ENPP2 2226/4885CYP1A2 688/4885

“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.