SCHEMBL2608529

SCHEMBL2608529

Cc1c(Cl)nc2cccc(F)c2c1O

nearest known ligand 0.44

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PARP1 P09874 4/20 0.44
TDP1 Q9NUW8 1/20 0.36
DHODH Q02127 2/20 0.35
ACHE P22303 2/20 0.35
ELANE P08246 1/20 0.35
TNKS O95271 1/20 0.35
TNKS2 Q9H2K2 1/20 0.35
PABPC1 P11940 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.33
KCNH2 Q12809 1/20 0.33
PDE10A Q9Y233 1/20 0.33
BCHE P06276 1/20 0.33
HSP90AB1 P08238 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
SCHEMBL2124953 0.83 PARP1 (0.46) PARP1TDP1ACHETNKSTNKS2
SCHEMBL2126781 0.83 PARP1 (0.46) PARP1TDP1ACHEELANETNKS
SCHEMBL14842829 0.74 PARP1 (0.47) PARP1TDP1ACHEELANEL3MBTL1
SCHEMBL538144 0.73 TDP1 (0.43) PARP1TDP1ACHEELANETNKS
SCHEMBL14842795 0.70 PARP1 (0.47) PARP1ACHEELANETNKSTNKS2
SCHEMBL2822958 0.70 KDM4E (0.35) PARP1DHODHPDE10A
SCHEMBL1995692 0.69 PARP1 (0.42) PARP1TDP1ACHEELANETNKS
SCHEMBL29909242 0.69 PARP1 (0.42) PARP1TDP1ACHEELANETNKS
SCHEMBL537851 0.69 PARP1 (0.46) PARP1ACHEELANEKCNH2PDE10A
SCHEMBL2125021 0.69 PARP1 (0.40) PARP1ACHETNKSTNKS2KCNH2

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-8765940-B2 Heterocyclic compounds and their uses AMGEN INC. (US) 2014-07-01 US disclosed
US-8765940-B2 Heterocyclic compounds and their uses AMGEN INC. (US) 2014-07-01 US disclosed
US-20120094972-A1 HETEROCYCLIC COMPOUNDS AND THEIR USES AMGEN INC. (US) 2012-04-19 US disclosed
US-20120094972-A1 HETEROCYCLIC COMPOUNDS AND THEIR USES AMGEN INC. (US) 2012-04-19 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-20120094972-A1 HETEROCYCLIC COMPOUNDS AND THEIR USES MCL1, MALT1, BCL9 PARP1 978/4885TDP1 2061/4885DHODH 2656/4885

“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.