SCHEMBL4881920

SCHEMBL4881920

Nc1c2c(nn1-c1ccc(Cl)cc1)CSC2

nearest known ligand 0.56

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
TP53 P04637 1/20 0.47
ENPP2 Q13822 2/20 0.44
MAPT P10636 2/20 0.41
LMNA P02545 1/20 0.41
MEN1 O00255 2/20 0.40
KMT2A Q03164 2/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
SRC P12931 1/20 0.37
BRAF P15056 1/20 0.37
KDR P35968 1/20 0.37
TSHR P16473 1/20 0.37
PTGS1 P23219 1/20 0.37

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
SCHEMBL24176322 0.84 ENPP2 (0.49) ENPP2MEN1KMT2ATSHR
SCHEMBL4882490 0.84 TSHR (0.49) TP53MAPTLMNAMEN1KMT2A
SCHEMBL4940565 0.84 MAPT (0.47) TP53ENPP2MAPTLMNAMEN1
SCHEMBL24176343 0.83 ENPP2 (0.46) TP53ENPP2MAPTLMNAMEN1
SCHEMBL3145312 0.81 MAPT (0.49) MAPTLMNAMEN1KMT2ASMN1; SMN2
SCHEMBL4878309 0.76 PTGS2 (0.49) ENPP2MAPTMEN1KMT2ASMN1; SMN2
SCHEMBL4882030 0.76 PTGS2 (0.46) ENPP2MAPTMEN1KMT2ASMN1; SMN2
SCHEMBL4880737 0.69 TP53 (0.41) TP53ENPP2MAPTLMNAKMT2A
SCHEMBL11739347 0.69 ENPP2 (0.39) TP53ENPP2MAPTLMNAMEN1
SCHEMBL11740750 0.69 TP53 (0.40) TP53ENPP2MAPTLMNAMEN1

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 2226/4885MAPT 2701/4885

“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.