SCHEMBL14718929

SCHEMBL14718929

O=c1[nH]nc2c3c(cc(F)cc13)NNC(c1ccccc1)C2c1ncnn1CCCO

nearest known ligand 0.62

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PARP1 P09874 20/20 0.62
PARP2 Q9UGN5 15/20 0.56
PARP3 Q9Y6F1 15/20 0.56
TNKS O95271 2/20 0.55
PARP10 Q53GL7 2/20 0.55
PARP16 Q8N5Y8 2/20 0.55
PARP4 Q9UKK3 2/20 0.55
PARP15 Q460N3 1/20 0.55
PARP14 Q460N5 1/20 0.55
TNKS2 Q9H2K2 1/20 0.55
PARP8 Q8N3A8 1/20 0.55
PARP11 Q9NR21 1/20 0.55

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
SCHEMBL14719630 0.95 PARP1 (0.64) PARP1PARP2PARP3TNKSPARP10
SCHEMBL14718536 0.94 PARP1 (0.62) PARP1PARP2PARP3TNKSPARP10
SCHEMBL14719166 0.90 PARP1 (0.67) PARP1PARP2PARP3TNKSPARP10
SCHEMBL14719313 0.90 PARP1 (0.64) PARP1PARP2PARP3TNKSPARP10
SCHEMBL14719018 0.89 PARP1 (0.54) PARP1PARP2PARP3TNKSPARP10
SCHEMBL14718581 0.89 PARP1 (0.56) PARP1PARP2PARP3TNKSPARP10
SCHEMBL14718576 0.89 PARP1 (0.66) PARP1PARP2PARP3TNKSPARP10
SCHEMBL14719385 0.88 PARP1 (0.51) PARP1PARP2PARP3TNKSPARP10
SCHEMBL14718941 0.86 PARP1 (0.62) PARP1PARP2PARP3TNKSPARP10
SCHEMBL14718805 0.86 PARP1 (0.57) PARP1PARP2PARP3TNKSPARP10

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-20130053365-A1 DIHYDROPYRIDOPHTHALAZINONE INHIBITORS OF POLY(ADP-RIBOSE)POLYMERASE (PARP) BIOMARIN PHARMACEUTICAL, INC. (US) 2013-02-28 US claimed
US-20130053365-A1 DIHYDROPYRIDOPHTHALAZINONE INHIBITORS OF POLY(ADP-RIBOSE)POLYMERASE (PARP) BIOMARIN PHARMACEUTICAL, INC. (US) 2013-02-28 US disclosed
US-20130053365-A1 DIHYDROPYRIDOPHTHALAZINONE INHIBITORS OF POLY(ADP-RIBOSE)POLYMERASE (PARP) BIOMARIN PHARMACEUTICAL, INC. (US) 2013-02-28 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-20130053365-A1 DIHYDROPYRIDOPHTHALAZINONE INHIBITORS OF POLY(ADP-RIBOSE)POLYMERASE (PARP) PARP1, PARP2, PARP3 PARP1 1/4885PARP2 2/4885PARP3 3/4885

“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.