SCHEMBL17298078

SCHEMBL17298078

CCc1nc2c(OC)cccc2c(=O)[nH]1

nearest known ligand 0.67

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
TNKS2 Q9H2K2 11/20 0.60
TNKS O95271 10/20 0.60
PARP2 Q9UGN5 6/20 0.60
PARP14 Q460N5 1/20 0.59
PARP1 P09874 5/20 0.58
KDM4E B2RXH2 2/20 0.51
ALDH1A1 P00352 2/20 0.50
GLA P06280 1/20 0.50
L3MBTL1 Q9Y468 1/20 0.50
USP2 O75604 1/20 0.47
ALOX15 P16050 1/20 0.47
MAPK1 P28482 1/20 0.47

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
SCHEMBL30186048 0.87 TNKS (0.59) TNKS2TNKSPARP2PARP14PARP1
SCHEMBL6930649 0.87 TNKS (0.59) TNKS2TNKSPARP2PARP14PARP1
SCHEMBL19104690 0.85 TNKS (0.56) TNKS2TNKSPARP2PARP14PARP1
SCHEMBL3980805 0.80 TNKS (0.65) TNKS2TNKSPARP2PARP14PARP1
SCHEMBL21127496 0.80 PARP14 (0.60) TNKS2TNKSPARP2PARP14PARP1
SCHEMBL17298080 0.80 PARP1 (0.66) TNKS2TNKSPARP2PARP14PARP1
SCHEMBL1387202 0.80 TNKS2 (0.66) TNKS2TNKSPARP2PARP14PARP1
SCHEMBL3423314 0.79 TNKS (0.67) TNKS2TNKSPARP2PARP14PARP1
SCHEMBL15857995 0.79 TNKS (0.67) TNKS2TNKSPARP2PARP14PARP1
SCHEMBL8438092 0.79 PARP1 (0.65) TNKS2TNKSPARP2PARP14PARP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170197958-A1 AGONISTS OF THE APELIN RECEPTOR AND METHODS OF USE THEREOF Sanford Burnham Prebys Medical Discovery Institute 2017-07-13 US disclosed
WO-2015184011-A2 AGONISTS OF THE APELIN RECEPTOR AND METHODS OF USE THEREOF SANFORD-BURNHAM MEDICAL RESEARCH INSTITUTE (US) 2015-12-03 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-20170197958-A1 AGONISTS OF THE APELIN RECEPTOR AND METHODS OF USE THEREOF APLNR, AGTR1, AGTR2 TNKS2 4481/4885TNKS 4665/4885PARP2 4519/4885

“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.