SCHEMBL4897891

SCHEMBL4897891

[CH2]CC(=O)N(O)CCCC

nearest known ligand 0.46

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
KDM5A P29375 10/20 0.46
KDM4C Q9H3R0 10/20 0.46
PHF8 Q9UPP1 4/20 0.43
KDM4A O75164 2/20 0.43
KDM5C P41229 1/20 0.41
KDM5B Q9UGL1 1/20 0.41
CA12 O43570 2/20 0.40
CA1 P00915 2/20 0.40
CA9 Q16790 2/20 0.40
ALDH1A1 P00352 1/20 0.38
MMP1 P03956 1/20 0.38
MMP2 P08253 1/20 0.38
MMP3 P08254 1/20 0.38
MMP8 P22894 1/20 0.38

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
SCHEMBL4895195 0.86
SCHEMBL4897985 0.83 KDM5A (0.51) KDM5AKDM4CPHF8KDM4AKDM5C
SCHEMBL8815683 0.81 KDM5A (0.48) KDM5AKDM4CPHF8KDM4AKDM5C
SCHEMBL4894918 0.81 KDM5A (0.54) KDM5AKDM4CPHF8KDM4AKDM5C
SCHEMBL5143909 0.79 KDM5A (0.47) KDM5AKDM4CPHF8KDM4AKDM5C
SCHEMBL21389643 0.79 KDM5A (0.56) KDM5AKDM4CPHF8KDM4AKDM5C
SCHEMBL5209092 0.79 CA1 (0.52) CA12CA1CA9ALDH1A1MMP1
SCHEMBL28307831 0.77 KDM5A (0.66) KDM5AKDM4CPHF8KDM4AKDM5C
SCHEMBL5207863 0.77 ALDH1A1 (0.43) KDM5AKDM4CPHF8KDM4ACA12
SCHEMBL4894337 0.76

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-20080194590-A1 4-Piperazinylthieno [2,3-D] Pyrimidine Compounds as Platelet Aggregation Inhibitors PFIZER INC 2008-08-14 US disclosed
EP-1869051-A1 4-PIPERAZINYLTHIENO Ý2,3-D¨PYRIMIDINE COMPOUNDS AS PLATELET AGGREGATION INHIBITORS Pharmacia & Upjohn Company LLC (US) 2007-12-26 EP disclosed
WO-2006103545-A1 4-PIPERAZINYLTHIENO [2,3-D] PYRIMIDINE COMPOUNDS AS PLATELET AGGREGATION INHIBITORS PHARMACIA & UPJOHN COMPANY LLC (US) 2006-10-05 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-20080194590-A1 4-Piperazinylthieno [2,3-D] Pyrimidine Compounds as Platelet Aggregation Inhibitors PFKP, PF4, P2RY4 KDM5A 3284/4885KDM4C 2349/4885PHF8 1863/4885

“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.