SCHEMBL5235050

SCHEMBL5235050

CCCNc1ccnc2sc(C(N)=O)c(N)c12

nearest known ligand 0.61

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
IKBKB O14920 7/20 0.61
ALDH1A1 P00352 3/20 0.61
KDM4E B2RXH2 2/20 0.61
HTT P42858 2/20 0.61
HPGD P15428 2/20 0.61
ALOX15 P16050 2/20 0.61
TSHR P16473 2/20 0.61
MAPK1 P28482 1/20 0.61
HSD17B10 Q99714 1/20 0.61
LIMK1 P53667 2/20 0.60
CDK8 P49336 9/20 0.60
CDK19 Q9BWU1 3/20 0.60
CHUK O15111 1/20 0.46
GRM1 Q13255 1/20 0.45
LMNA P02545 1/20 0.44
NPSR1 Q6W5P4 1/20 0.44

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
SCHEMBL5234359 0.84 ALDH1A1 (0.60) IKBKBALDH1A1KDM4EHTTHPGD
SCHEMBL5236613 0.84 ALDH1A1 (0.60) IKBKBALDH1A1KDM4EHTTHPGD
SCHEMBL5236328 0.83 ALDH1A1 (0.66) IKBKBALDH1A1KDM4EHTTHPGD
SCHEMBL27702802 0.82 KDM4E (0.61) IKBKBALDH1A1KDM4EHTTHPGD
SCHEMBL5239520 0.82 ALDH1A1 (0.64) IKBKBALDH1A1KDM4EHTTHPGD
SCHEMBL27723169 0.81 IKBKB (0.57) IKBKBALDH1A1KDM4EHTTHPGD
SCHEMBL16071472 0.81 KDM4E (0.62) IKBKBALDH1A1KDM4EHTTHPGD
SCHEMBL16071477 0.81 KDM4E (0.65) IKBKBALDH1A1KDM4EHTTHPGD
SCHEMBL5234057 0.81 ALDH1A1 (0.69) IKBKBALDH1A1KDM4EHTTHPGD
SCHEMBL5236334 0.79 ALDH1A1 (0.69) IKBKBALDH1A1KDM4EHTTHPGD

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-20070219234-A1 Thienopyridine Derivatives SANKYO COMPANY, LIMITED (JP) 2007-09-20 US disclosed
EP-1764367-A1 THIENOPYRIDINE DERIVATIVES Sankyo Company, Limited (JP) 2007-03-21 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-20070219234-A1 Thienopyridine Derivatives RASGRP1, NRAS, HRH3 IKBKB 1715/4885ALDH1A1 1073/4885KDM4E 1851/4885

“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.