SCHEMBL6799475

SCHEMBL6799475

Cn1c(C(=O)NC(=N)N)cc2c(Cl)ccc(OCC(=O)O)c21

nearest known ligand 0.43

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 3/20 0.43
TSHR P16473 1/20 0.43
CYP2C19 P33261 1/20 0.39
RORC P51449 1/20 0.38
KMT2A Q03164 1/20 0.37
MCL1 Q07820 1/20 0.36
MAPT P10636 2/20 0.36
PTGDR2 Q9Y5Y4 5/20 0.36
PTGDR Q13258 1/20 0.36
KDM4E B2RXH2 2/20 0.35
PHGDH O43175 1/20 0.35
LMNA P02545 1/20 0.35
HTT P42858 1/20 0.35
ITGB3 P05106 1/20 0.35
ITGA2B P08514 1/20 0.35
WDR5 P61964 1/20 0.35

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
SCHEMBL6799248 0.89 KMT2A (0.39) TDP1TSHRRORCKMT2APTGDR2
SCHEMBL6804603 0.87 FBP1 (0.34) TDP1KMT2AMAPTKDM4EPHGDH
SCHEMBL6798113 0.85 RORC (0.36) TDP1TSHRRORCKMT2APTGDR2
SCHEMBL6799899 0.83 KDM4E (0.35) KMT2AMAPTKDM4EPHGDHLMNA
SCHEMBL6799905 0.81 PHGDH (0.35) KMT2AMAPTKDM4EPHGDHLMNA
SCHEMBL6798676 0.78 PHGDH (0.38) TDP1KMT2AMCL1KDM4EPHGDH
SCHEMBL6798666 0.77 THRB (0.31) MAPTKDM4EPHGDH
SCHEMBL6797142 0.77 RXFP1 (0.32) MAPTKDM4EPHGDH
SCHEMBL6800597 0.76 FBP1 (0.35) TSHRKMT2AMAPTKDM4ELMNA
SCHEMBL7877514 0.73 SMN1; SMN2 (0.46) TSHRKMT2AKDM4ELMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6734205-B2 SODIUM CHANNEL MODERATORS; CARDIOVASCULAR DISORDERS; ANTIDIABETIC AGENTS SUMITOMO PHARMACEUTICALS COMPANY LIMITED (JP) 2004-05-11 US disclosed
US-20030018056-A1 Substituted guanidine derivatives SUMITOMO PHARMACEUTICALS COMPANY LIMITED (JP) 2003-01-23 US disclosed
EP-1238971-A1 SUBSTITUTED GUANIDINE DERIVATIVES SUMITOMO PHARMACEUTICALS COMPANY, LIMITED (JP) 2002-09-11 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-20030018056-A1 Substituted guanidine derivatives SLC28A1, SLC7A1, ABCB11 TDP1 1752/4885TSHR 1959/4885CYP2C19 219/4885

“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.