SCHEMBL5774068

SCHEMBL5774068

Cc1cccc2c(-c3nc(C(=O)OC4CCN(C)C4)c(-c4cccnc4)s3)n[nH]c12

nearest known ligand 0.43

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
DYRK1A Q13627 3/20 0.39
WNT1 P04628 2/20 0.38
PIM1 P11309 8/20 0.37
ATM Q13315 1/20 0.36
KDM5A P29375 1/20 0.36

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
SCHEMBL5771721 0.95 DYRK1A (0.41) DYRK1AWNT1PIM1
SCHEMBL5873102 0.85 DYRK1A (0.49) DYRK1AWNT1PIM1
SCHEMBL5775521 0.83 DYRK1A (0.55) DYRK1AWNT1PIM1
SCHEMBL5775974 0.83 ATAD2 (0.40) DYRK1AWNT1
SCHEMBL5795447 0.81 PIM1 (0.41) DYRK1APIM1
SCHEMBL5770580 0.81 CDC7 (0.47)
SCHEMBL5770048 0.80 PIM1 (0.43) PIM1KDM5A
SCHEMBL5772558 0.80 ADORA2A (0.39) PIM1KDM5A
SCHEMBL5747881 0.80 KDM4E (0.45) DYRK1AWNT1PIM1
SCHEMBL5872880 0.79 CYP2C9 (0.43) PIM1KDM5A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1664040-A1 GYRASE INHIBITORS PFIZER INC. (US) 2006-06-07 EP disclosed
US-6984652-B2 Gyrase inhibitors WARNER-LAMBERT COMPANY LLC (US) 2006-01-10 US disclosed
US-20050250823-A1 Gyrase inhibitors YAGER KRAIG 2005-11-10 US disclosed
WO-2005026162-A1 GYRASE INHIBITORS PFIZER INC. (US) 2005-03-24 WO disclosed
US-20050054697-A1 Gyrase inhibitors PFIZER INC. 2005-03-10 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 (2 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-20050054697-A1 Gyrase inhibitors TOP1, TOP2A, TOP2B DYRK1A 1836/4885WNT1 3712/4885PIM1 1909/4885
US-20050250823-A1 Gyrase inhibitors TOP1, TOP2A, TOP2B DYRK1A 1836/4885WNT1 3712/4885PIM1 1909/4885

“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.