SCHEMBL3450340

SCHEMBL3450340

O=C(O)c1cncc(-c2cnc(Nc3ccc(F)c(Cl)c3)nc2-n2nnc3ccccc32)c1

nearest known ligand 0.42

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CSNK2A1 P68400 11/20 0.42
CSNK2A2 P19784 2/20 0.42
CSNK2B P67870 2/20 0.42
AURKA O14965 4/20 0.42
GSK3A P49840 1/20 0.42
GSK3B P49841 1/20 0.42
APAF1 O14727 2/20 0.42
NPC1 O15118 2/20 0.42
RAB9A P51151 2/20 0.42
TDP2 O95551 1/20 0.40
MAPT P10636 1/20 0.40
JAK2 O60674 1/20 0.40
AURKB Q96GD4 1/20 0.40
MKNK2 Q9HBH9 1/20 0.39
XDH P47989 1/20 0.39
SLC22A12 Q96S37 1/20 0.39
ABCG2 Q9UNQ0 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
SCHEMBL3449978 0.89 CSNK2A1 (0.43) CSNK2A1CSNK2A2CSNK2BAURKAJAK2
SCHEMBL3450048 0.89 RXFP1 (0.40) CSNK2A1NPC1RAB9AMAPTMKNK2
SCHEMBL3449434 0.87 MKNK2 (0.43) CSNK2A1CSNK2A2CSNK2BGSK3AGSK3B
SCHEMBL3449164 0.87 AURKA (0.41) CSNK2A1CSNK2A2CSNK2BAURKAGSK3A
SCHEMBL3449444 0.84 MAPK1 (0.46) CSNK2A1MKNK2ABCG2
SCHEMBL3449152 0.83 XDH (0.43) CSNK2A1CSNK2A2CSNK2BAURKAGSK3A
SCHEMBL3448423 0.83 CSNK2A1 (0.41) CSNK2A1CSNK2A2CSNK2BAURKAGSK3A
SCHEMBL3448169 0.82 AURKA (0.46) CSNK2A1CSNK2A2CSNK2BAURKAGSK3A
SCHEMBL3448165 0.82 AURKA (0.46) CSNK2A1CSNK2A2CSNK2BAURKAGSK3A
SCHEMBL3434606 0.82 KCNN3 (0.46) CSNK2A1CSNK2A2CSNK2BAURKAJAK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100137313-A1 HETEROCYCLIC DERIVATIVES AND METHODS OF USE THEREOF ASTRAZENECA AB 2010-06-03 US disclosed
US-20100137313-A1 HETEROCYCLIC DERIVATIVES AND METHODS OF USE THEREOF ASTRAZENECA AB 2010-06-03 US disclosed
US-20100137313-A1 HETEROCYCLIC DERIVATIVES AND METHODS OF USE THEREOF ASTRAZENECA AB 2010-06-03 US disclosed
WO-2010038081-A2 HETEROCYCLIC DERIVATIVES AND METHODS OF USE THEREOF ASTRAZENECA AB (SE) 2010-04-08 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-20100137313-A1 HETEROCYCLIC DERIVATIVES AND METHODS OF USE THEREOF SDHA, SDHB, UROD CSNK2A1 1858/4885CSNK2A2 1967/4885CSNK2B 1624/4885

“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.