SCHEMBL1870201

SCHEMBL1870201

C=C(N)Cc1cccc2ncc3ccccc3c12

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.45
GPR3 P46089 1/20 0.45
PLAU P00749 1/20 0.36
MTNR1A P48039 2/20 0.35
TDP1 Q9NUW8 1/20 0.34
HTT P42858 5/20 0.34
HPGD P15428 2/20 0.34
PIM1 P11309 1/20 0.34
KMT2A Q03164 2/20 0.33
SMN1; SMN2 Q16637 2/20 0.33
ALDH1A1 P00352 2/20 0.33
POLB P06746 1/20 0.33
MAPT P10636 1/20 0.33
CRHBP P24387 1/20 0.33
GALK1 P51570 1/20 0.33
CRHR2 Q13324 1/20 0.33
MTNR1B P49286 1/20 0.33
MEN1 O00255 1/20 0.33
NPC1 O15118 1/20 0.33
LMNA P02545 1/20 0.33

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
SCHEMBL9935648 0.82 KDM4E (0.53) KDM4EGPR3TDP1HTTHPGD
SCHEMBL27279082 0.80 KDM4E (0.52) KDM4EGPR3HTTHPGDKMT2A
SCHEMBL27588351 0.80 KDM4E (0.52) KDM4EGPR3HTTHPGDKMT2A
SCHEMBL9935646 0.79 KDM4E (0.53) KDM4EGPR3TDP1HTTHPGD
SCHEMBL28355479 0.77 KDM4E (0.52) KDM4EGPR3HTTHPGDKMT2A
SCHEMBL5801178 0.77 KDM4E (0.52) KDM4EGPR3HTTKMT2ASMN1; SMN2
SCHEMBL1505063 0.77 KDM4E (0.47) KDM4EGPR3HTTKMT2ASMN1; SMN2
SCHEMBL28374660 0.77 KDM4E (0.47) KDM4EGPR3MTNR1AHTTHPGD
SCHEMBL4033783 0.75 KDM4E (0.49) KDM4EGPR3KMT2AMEN1
SCHEMBL10976790 0.75 KDM4E (0.49) KDM4EGPR3HPGDALDH1A1

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 10 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7947703-B2 Phenanthridinium derivatives as DNA binding agents UNIVERSITY COURT OF THE UNIVERSITY OF GLASGOW (GB) 2011-05-24 US disclosed
US-20070249652-A1 Phenanthridinium Derivatives as Dna Binding Agents UNIVERSITY COURT OF THE UNIVERSITY OF GLASGOW (GB) 2007-10-25 US disclosed
US-20070249652-A1 Phenanthridinium Derivatives as Dna Binding Agents UNIVERSITY COURT OF THE UNIVERSITY OF GLASGOW (GB) 2007-10-25 US disclosed
EP-1692130-B1 PHENANTHRIDINIUM DERIVATIVES AS DNA BINDING AGENTS UNIV GLASGOW (GB) 2007-08-08 EP disclosed
EP-1692130-B1 PHENANTHRIDINIUM DERIVATIVES AS DNA BINDING AGENTS UNIV GLASGOW (GB) 2007-08-08 EP disclosed
EP-1692130-A2 PHENANTHRIDINIUM DERIVATIVES AS DNA BINDING AGENTS University Court of The University of Glasgow (GB) 2006-08-23 EP disclosed
EP-1692130-A2 PHENANTHRIDINIUM DERIVATIVES AS DNA BINDING AGENTS University Court of The University of Glasgow (GB) 2006-08-23 EP disclosed
WO-2005054241-A3 PHENANTHRIDINIUM DERIVATIVES AS DNA BINDING AGENTS UNIV GLASGOW (GB) 2005-07-28 WO disclosed
WO-2005054241-A2 PHENANTHRIDINIUM DERIVATIVES AS DNA BINDING AGENTS THE UNIVERSITY COURT OF THE UNIVERSITY OF GLASGOW (GB) 2005-06-16 WO disclosed
WO-2005054241-A2 PHENANTHRIDINIUM DERIVATIVES AS DNA BINDING AGENTS THE UNIVERSITY COURT OF THE UNIVERSITY OF GLASGOW (GB) 2005-06-16 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-20070249652-A1 Phenanthridinium Derivatives as Dna Binding Agents DNA2, DDB1, TOP2B KDM4E 2276/4885GPR3 3483/4885PLAU 4853/4885

“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.