SCHEMBL9104437

SCHEMBL9104437

Cc1cc(C(=O)O)cc2c(O)ccnc12

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 7/20 0.41
KDM4A O75164 5/20 0.41
EGLN1 Q9GZT9 3/20 0.41
HIF1AN Q9NWT6 2/20 0.41
L3MBTL1 Q9Y468 2/20 0.41
RAB9A P51151 1/20 0.41
KDM4C Q9H3R0 7/20 0.40
KDM5B Q9UGL1 6/20 0.40
KDM5A P29375 4/20 0.40
KDM5C P41229 4/20 0.40
ALDH1A1 P00352 3/20 0.40
KDM6B O15054 3/20 0.40
KDM2A Q9Y2K7 3/20 0.40
KDM3A Q9Y4C1 3/20 0.40
TET3 O43151 2/20 0.40
KDM4D Q6B0I6 2/20 0.40
TET2 Q6N021 2/20 0.40
ALKBH5 Q6P6C2 2/20 0.40
TET1 Q8NFU7 2/20 0.40
FTO Q9C0B1 2/20 0.40

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
SCHEMBL9907496 0.87 CCR1 (0.47) KDM4EKDM4AEGLN1HIF1ANL3MBTL1
SCHEMBL9907413 0.83 KDM4E (0.45) KDM4EL3MBTL1KDM4CKDM5CALDH1A1
SCHEMBL9907414 0.81 TTR (0.47) KDM4EKDM4AEGLN1HIF1ANL3MBTL1
SCHEMBL9907435 0.81 KDM4E (0.41) KDM4EKDM4AEGLN1HIF1ANL3MBTL1
SCHEMBL16517772 0.81 CCR1 (0.44) KDM4EKDM4AEGLN1HIF1ANL3MBTL1
SCHEMBL27185293 0.80 CA12 (0.44) KDM4ERAB9AKDM4CKDM5BKDM5A
SCHEMBL9907439 0.77 SLC6A2 (0.38) KDM4EKDM4AEGLN1HIF1ANL3MBTL1
SCHEMBL9907512 0.75 KDM4C (0.47) KDM4EKDM4AKDM4CKDM5BKDM5A
SCHEMBL9907418 0.75 HTR5A (0.41) KDM4AKDM4CKDM5BKDM5ATTR
SCHEMBL9907425 0.75 PTGDR2 (0.47) TTRDYRK1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8853242-B2 Nitrogenous-ring acylguanidine derivative ASTELLAS PHARMA INC. (JP) 2014-10-07 US disclosed
US-8853242-B2 Nitrogenous-ring acylguanidine derivative ASTELLAS PHARMA INC. (JP) 2014-10-07 US disclosed
US-8853242-B2 Nitrogenous-ring acylguanidine derivative ASTELLAS PHARMA INC. (JP) 2014-10-07 US disclosed
EP-2463276-B1 NITROGENOUS-RING ACYLGUANIDINE DERIVATIVE ASTELLAS PHARMA INC (JP) 2014-03-12 EP disclosed
EP-2463276-A1 NITROGENOUS-RING ACYLGUANIDINE DERIVATIVE Astellas Pharma Inc. (JP) 2012-06-13 EP disclosed
US-20120142727-A1 NITROGENOUS-RING ACYLGUANIDINE DERIVATIVE ASTELLAS PHARMA INC. (JP) 2012-06-07 US disclosed
US-20120142727-A1 NITROGENOUS-RING ACYLGUANIDINE DERIVATIVE ASTELLAS PHARMA INC. (JP) 2012-06-07 US disclosed
US-20120142727-A1 NITROGENOUS-RING ACYLGUANIDINE DERIVATIVE ASTELLAS PHARMA INC. (JP) 2012-06-07 US 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-20120142727-A1 NITROGENOUS-RING ACYLGUANIDINE DERIVATIVE HTR5A, HTR2A, HTR1E KDM4E 1474/4885KDM4A 1645/4885EGLN1 4544/4885

“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.