SCHEMBL6316381

SCHEMBL6316381

Cn1c(=O)c2nc(C=Cc3cccnc3)cnc2n(C)c1=O

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.46
MEN1 O00255 2/20 0.46
NPC1 O15118 2/20 0.46
RAB9A P51151 2/20 0.46
KDM4E B2RXH2 6/20 0.45
LMNA P02545 1/20 0.45
CASP1 P29466 1/20 0.45
CASP7 P55210 1/20 0.45
HSD17B10 Q99714 1/20 0.45
GRM4 Q14833 1/20 0.44
ALDH1A1 P00352 5/20 0.44
TSHR P16473 1/20 0.44
GRM5 P41594 1/20 0.43
GAA P10253 2/20 0.42
USP2 O75604 1/20 0.42
RECQL P46063 1/20 0.42
MAPT P10636 3/20 0.41
HKDC1 Q2TB90 2/20 0.41
CYP11B1 P15538 1/20 0.41
CYP11B2 P19099 1/20 0.41

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
SCHEMBL6322883 0.90 KMT2A (0.46) KMT2AMEN1NPC1RAB9AKDM4E
SCHEMBL6315474 0.89 KDM4E (0.53) KMT2AMEN1NPC1RAB9AKDM4E
SCHEMBL5440337 0.89 KDM4E (0.53) KMT2AMEN1NPC1RAB9AKDM4E
SCHEMBL6316300 0.88 KDM4E (0.44) KMT2AMEN1KDM4ELMNACASP1
SCHEMBL5442970 0.79 MAOB (0.49) KMT2AMEN1KDM4ELMNACASP1
SCHEMBL6321029 0.79 KDM4E (0.50) KMT2AMEN1NPC1RAB9AKDM4E
SCHEMBL6315381 0.78 ALDH1A1 (0.43) KDM4ELMNACASP1CASP7HSD17B10
SCHEMBL5434551 0.76 MAPT (0.41) KMT2AMEN1KDM4ELMNACASP1
SCHEMBL6314712 0.76 ALDH1A1 (0.49) KMT2AMEN1KDM4ELMNACASP1
SCHEMBL6314656 0.73 KDM4E (0.45) KMT2AMEN1KDM4ELMNACASP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6946465-B2 Immunosuppressive effects of pteridine derivatives 4 AZA BIOSCIENCE NV (BE) 2005-09-20 US claimed
US-20030236255-A1 Immunosuppressive effects of pteridine derivatives 4 AZA BIOSCIENCE NV (BE) 2003-12-25 US claimed
EP-1187615-A2 IMMUNOSURPRESSIVE EFFECTS OF PTERIDINE DERIVATIVES K.U. Leuven Research & Development (BE) 2002-03-20 EP claimed
WO-2000045800-A2 IMMUNOSURPRESSIVE EFFECTS OF PTERIDINE DERIVATIVES K.U. LEUVEN RESEARCH & DEVELOPMENT (BE) 2000-08-10 WO claimed
US-6946465-B2 Immunosuppressive effects of pteridine derivatives 4 AZA BIOSCIENCE NV (BE) 2005-09-20 US disclosed
US-20030236255-A1 Immunosuppressive effects of pteridine derivatives 4 AZA BIOSCIENCE NV (BE) 2003-12-25 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-20030236255-A1 Immunosuppressive effects of pteridine derivatives TPMT, FKBP5, RRP15 KMT2A 1154/4885MEN1 2517/4885NPC1 3612/4885

“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.