SCHEMBL4874779

SCHEMBL4874779

O=C(Cc1ccc(F)cc1)Nc1c2c(nn1-c1ccc(Cl)cc1)CSC2

nearest known ligand 0.81

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ENPP2 Q13822 2/20 0.81
TSHR P16473 2/20 0.67
MEN1 O00255 1/20 0.62
KMT2A Q03164 1/20 0.62
POLB P06746 1/20 0.60
MAPT P10636 1/20 0.57
LMNA P02545 1/20 0.56
TP53 P04637 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
SCHEMBL4883506 0.90 ENPP2 (0.81) ENPP2TSHRMEN1KMT2APOLB
SCHEMBL4882847 0.90 ENPP2 (0.66) ENPP2TSHRKMT2AMAPTTP53
SCHEMBL4882017 0.85 ENPP2 (0.60) ENPP2TSHRMEN1KMT2AMAPT
SCHEMBL14024422 0.84 ENPP2 (0.58) ENPP2TSHRMEN1KMT2APOLB
SCHEMBL4878903 0.84 ENPP2 (0.58) ENPP2TSHRMEN1KMT2APOLB
Hydrochloric Acid SCHEMBL4880131 0.83 ENPP2 (0.57) ENPP2TSHRMEN1KMT2APOLB
SCHEMBL4881088 0.80 MAPT (0.73) ENPP2TSHRMEN1KMT2APOLB
SCHEMBL4883373 0.80 MAPT (0.59) ENPP2TSHRKMT2AMAPTTP53
SCHEMBL4874955 0.79 ENPP2 (0.66) ENPP2TSHRMEN1KMT2APOLB
SCHEMBL4878939 0.79 TSHR (0.72) ENPP2TSHRMEN1KMT2APOLB

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 ENPP2 2226/4885TSHR 214/4885MEN1 2666/4885

“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.