SCHEMBL17829943

SCHEMBL17829943

Cc1c(N2CCOCC2)ccc2c(=O)[nH]c(-c3cc(-c4ccccc4)cc(C(F)(F)F)c3)nc12

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TNKS O95271 5/20 0.42
TNKS2 Q9H2K2 5/20 0.42
PARP2 Q9UGN5 2/20 0.42
NPSR1 Q6W5P4 3/20 0.41
ATM Q13315 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
MEN1 O00255 2/20 0.40
KMT2A Q03164 2/20 0.40
POLB P06746 1/20 0.40
TSHR P16473 1/20 0.40
PARP1 P09874 2/20 0.40
MGLL Q99685 1/20 0.40
HSD17B10 Q99714 2/20 0.39
USP2 O75604 1/20 0.39
GAA P10253 1/20 0.39
WNT3A P56704 1/20 0.39
PRKDC P78527 2/20 0.38
ALDH1A1 P00352 2/20 0.38
LMNA P02545 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
SCHEMBL17829942 0.84 TNKS (0.48) TNKSTNKS2PARP2NPSR1ATM
SCHEMBL17829934 0.81 TNKS (0.50) TNKSTNKS2PARP2POLBPARP1
SCHEMBL17829939 0.80 TNKS (0.49) TNKSTNKS2PARP2POLBPARP1
SCHEMBL17829789 0.77 TNKS (0.60) TNKSTNKS2PARP2PARP1FLT3
SCHEMBL17829765 0.77 TNKS (0.71) TNKSTNKS2PARP2PARP1WNT3A
SCHEMBL17829778 0.75 TNKS (0.56) TNKSTNKS2PARP2PARP1WNT3A
SCHEMBL17829779 0.73 TNKS (0.57) TNKSTNKS2PARP2PARP1WNT3A
SCHEMBL17829933 0.72 TNKS (0.47) TNKSTNKS2PARP2POLBPARP1
SCHEMBL17829957 0.72 ALDH1A1 (0.42) NPSR1MEN1KMT2APOLBTSHR
SCHEMBL17829932 0.72 TNKS (0.52) TNKSTNKS2PARP2PARP1WNT3A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20160168140-A1 HETEROCYCLIC COMPOUNDS AS ANTIBIOTIC POTENTIATORS SYNERECA PHARMACEUTICALS (US) 2016-06-16 US disclosed
US-20160168140-A1 HETEROCYCLIC COMPOUNDS AS ANTIBIOTIC POTENTIATORS SYNERECA PHARMACEUTICALS (US) 2016-06-16 US disclosed
WO-2016094730-A1 HETEROCYCLIC COMPOUNDS AS ANTIBIOTIC POTENTIATORS SYNERECA PHARMACEUTICALS, INC. (US) 2016-06-16 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-20160168140-A1 HETEROCYCLIC COMPOUNDS AS ANTIBIOTIC POTENTIATORS FOS, FOSB, YAP1 TNKS 1771/4885TNKS2 2811/4885PARP2 3602/4885

“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.