SCHEMBL5273652

SCHEMBL5273652

Cc1ncc2c(n1)NC(=O)C2c1ncnc2cc(OCCCN3CCOCC3)ccc12

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CHEK1 O14757 1/20 0.65
AURKA O14965 3/20 0.43
AURKB Q96GD4 2/20 0.43
BRAF P15056 3/20 0.43
TNNI3K Q59H18 2/20 0.43
SIGMAR1 Q99720 4/20 0.42
MET P08581 2/20 0.42
SRC P12931 2/20 0.42
KDR P35968 2/20 0.42
CSF1R P07333 1/20 0.42
KIT P10721 1/20 0.42
FLT4 P35916 1/20 0.42
FLT3 P36888 1/20 0.42
GRM4 Q14833 1/20 0.41
EGFR P00533 1/20 0.40
RAF1 P04049 1/20 0.40
MAP2K1 Q02750 1/20 0.40
ACHE P22303 1/20 0.40
ALDH1A1 P00352 1/20 0.39
CYP1A2 P05177 1/20 0.39

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
SCHEMBL5272019 0.90 CHEK1 (0.52) CHEK1AURKAAURKBBRAFSIGMAR1
Hydrochloric Acid SCHEMBL5493932 0.88 CHEK1 (0.60) CHEK1AURKAAURKBBRAFTNNI3K
SCHEMBL5278912 0.86 CHEK1 (0.68) CHEK1AURKAAURKBBRAFTNNI3K
Hydrochloric Acid SCHEMBL5499642 0.85 CHEK1 (0.67) CHEK1AURKAAURKBBRAFTNNI3K
SCHEMBL5280709 0.84 CHEK1 (0.67) CHEK1AURKAAURKBBRAFTNNI3K
Hydrochloric Acid SCHEMBL5498930 0.84 CHEK1 (0.66) CHEK1AURKAAURKBBRAFTNNI3K
SCHEMBL7206444 0.82 CHEK1 (0.77) CHEK1AURKAAURKBBRAFTNNI3K
Hydrochloric Acid SCHEMBL5499449 0.82 CHEK1 (0.71) CHEK1AURKAAURKBBRAFTNNI3K
Hydrochloric Acid SCHEMBL5500537 0.81 CHEK1 (0.41) CHEK1EGFRHRH3
SCHEMBL5272907 0.81 CHEK1 (0.41) CHEK1METKDREGFR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1458395-B1 MEDICAL USE OF GSK3-INHIBITING OXINDOLE DERIVATIVES ASTRAZENECA AB (SE) 2007-11-28 EP claimed
EP-1005470-B1 OXINDOLYLQUINAZOLINE DERIVATIVES AS ANGIOGENESIS INHIBITORS ASTRAZENECA AB (SE) 2007-08-01 EP claimed
US-20050075351-A1 Use ASTRAZENECA AB (SE) 2005-04-07 US claimed
EP-1458395-A1 NEW USE AstraZeneca AB (SE) 2004-09-22 EP claimed
WO-2003053444-A1 NEW USE ASTRAZENECA AB (SE) 2003-07-03 WO claimed
US-6294532-B1 TREATMENT OF A NUMBER OF DISEASE STATES INCLUDING CANCER AND RHEUMATOID ARTHRITIS. ZENECA LIMITED (GB) 2001-09-25 US claimed
EP-1005470-A1 OXINDOLYLQUINAZOLINE DERIVATIVES AS ANGIOGENESIS INHIBITORS ZENECA LIMITED (GB) 2000-06-07 EP claimed
WO-1999010349-A1 OXINDOLYLQUINAZOLINE DERIVATIVES AS ANGIOGENESIS INHIBITORS ZENECA LIMITED (GB) 1999-03-04 WO claimed
EP-1458395-B1 MEDICAL USE OF GSK3-INHIBITING OXINDOLE DERIVATIVES ASTRAZENECA AB (SE) 2007-11-28 EP disclosed
EP-1005470-B1 OXINDOLYLQUINAZOLINE DERIVATIVES AS ANGIOGENESIS INHIBITORS ASTRAZENECA AB (SE) 2007-08-01 EP disclosed
US-20050075351-A1 Use ASTRAZENECA AB (SE) 2005-04-07 US disclosed
EP-1458395-A1 NEW USE AstraZeneca AB (SE) 2004-09-22 EP disclosed
WO-2003053444-A1 NEW USE ASTRAZENECA AB (SE) 2003-07-03 WO disclosed
US-6294532-B1 TREATMENT OF A NUMBER OF DISEASE STATES INCLUDING CANCER AND RHEUMATOID ARTHRITIS. ZENECA LIMITED (GB) 2001-09-25 US disclosed
EP-1005470-A1 OXINDOLYLQUINAZOLINE DERIVATIVES AS ANGIOGENESIS INHIBITORS ZENECA LIMITED (GB) 2000-06-07 EP disclosed
WO-1999010349-A1 OXINDOLYLQUINAZOLINE DERIVATIVES AS ANGIOGENESIS INHIBITORS ZENECA LIMITED (GB) 1999-03-04 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-20050075351-A1 Use GSK3A, GSK3B, PYGB CHEK1 1639/4885AURKA 775/4885AURKB 1133/4885

“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.