SCHEMBL6320948

SCHEMBL6320948

Clc1nc(Cl)c2nc(C3CCCCO3)[nH]c2n1

nearest known ligand 0.43

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ PTGES O14684 5/20 0.35
▸ YTHDC1 Q96MU7 1/20 0.33

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
SCHEMBL6947441 0.86 PTGES (0.36) PTGES
SCHEMBL17262847 0.75 PDE8B (0.36) —
SCHEMBL6326881 0.75 ADORA2A (0.35) PTGESYTHDC1
SCHEMBL19872920 0.68 PBK (0.36) —
SCHEMBL3115347 0.66 PTGES (0.37) PTGES
SCHEMBL14723131 0.66 AURKA (0.36) PTGES
SCHEMBL14250446 0.66 MAPK8 (0.34) —
SCHEMBL27035307 0.65 MAPK8 (0.34) —
Hydrochloric Acid SCHEMBL30769901 0.65 MAPK8 (0.34) —
Hydrochloric Acid SCHEMBL30769712 0.65 MAPK8 (0.34) —

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-20050124574-A1 Purine derivatives PFIZER INC. 2005-06-09 — — US disclosed
US-6900309-B1 Purine derivatives PFIZER INC (US) 2005-05-31 — — 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-20050124574-A1 Purine derivatives ADORA2A, ADORA3, ADORA1 PTGES 884/4885YTHDC1 1920/4885

“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.

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