SCHEMBL4699324

SCHEMBL4699324

O=C(Nc1ccc2c(Cc3cccnc3)n[nH]c(=O)c2c1)c1ccc(C(F)(F)F)cc1

nearest known ligand 0.55

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
HIF1A Q16665 6/20 0.55
EPAS1 Q99814 6/20 0.55
PARP1 P09874 6/20 0.53
TNKS O95271 1/20 0.53
TNKS2 Q9H2K2 1/20 0.53
EPHX2 P34913 2/20 0.50
MAPT P10636 2/20 0.49
DDR1 Q08345 1/20 0.48
DDR2 Q16832 1/20 0.48
MEN1 O00255 1/20 0.46
TSHR P16473 1/20 0.46
KMT2A Q03164 1/20 0.46
ABL1 P00519 1/20 0.45
BCR P11274 1/20 0.45
NPC1 O15118 1/20 0.45
TNF P01375 1/20 0.45
RAB9A P51151 1/20 0.45
NOD1 Q9Y239 1/20 0.45
L3MBTL1 Q9Y468 1/20 0.45

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
SCHEMBL4700461 0.90 PARP1 (0.52) PARP1
SCHEMBL4702145 0.86 MAPT (0.59) PARP1MAPTDDR1DDR2MEN1
SCHEMBL4698078 0.86 PARP1 (0.57) PARP1TNKSTNKS2
SCHEMBL4698386 0.85 PARP1 (0.54) PARP1TNKSTNKS2
SCHEMBL4700116 0.84 PARP1 (0.57) HIF1AEPAS1PARP1TNKSTNKS2
SCHEMBL4702139 0.83 PARP1 (0.50) HIF1AEPAS1PARP1TNKSTNKS2
SCHEMBL4697878 0.83 PARP1 (0.56) PARP1TNKSTNKS2
SCHEMBL4697702 0.83 PARP1 (0.51) PARP1TNKSTNKS2MAPT
SCHEMBL4699720 0.83 PARP1 (0.53) PARP1TNKSTNKS2MAPT
SCHEMBL4698716 0.82 PARP1 (0.52) PARP1TNKSTNKS2MAPTNPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7432263-B2 Amino-phthalazinone derivatives active as kinase inhibitors, process for their preparation and pharmaceutical compositions containing them PFIZER ITALIA, S.R.L. (IT) 2008-10-07 US claimed
EP-1427708-B1 AMINO-PHTHALAZINONE DERIVATIVES AS KINASE INHIBITORS, PROCESS FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM PFIZER ITALIA SRL (IT) 2008-09-10 EP claimed
US-20050020583-A1 Amino-phthalazinone derivatives active as kinase inhibitors, process for their preparation and pharmaceutical compositions containing them PFIZER ITALIA S.R.L. (IT) 2005-01-27 US claimed
US-20030073692-A1 Amino-phthalazinone derivatives active as kinase inhibitors, process for their preparation and pharmaceutical compositions containing them PHARMACIA & UPJOHN S.P.A. (IT) 2003-04-17 US claimed
US-7432263-B2 Amino-phthalazinone derivatives active as kinase inhibitors, process for their preparation and pharmaceutical compositions containing them PFIZER ITALIA, S.R.L. (IT) 2008-10-07 US disclosed
EP-1427708-B1 AMINO-PHTHALAZINONE DERIVATIVES AS KINASE INHIBITORS, PROCESS FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM PFIZER ITALIA SRL (IT) 2008-09-10 EP disclosed
US-20050020583-A1 Amino-phthalazinone derivatives active as kinase inhibitors, process for their preparation and pharmaceutical compositions containing them PFIZER ITALIA S.R.L. (IT) 2005-01-27 US disclosed
US-20030073692-A1 Amino-phthalazinone derivatives active as kinase inhibitors, process for their preparation and pharmaceutical compositions containing them PHARMACIA & UPJOHN S.P.A. (IT) 2003-04-17 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 (2 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-20030073692-A1 Amino-phthalazinone derivatives active as kinase inhibitors, process for their preparation and pharmaceutical compositions containing them MAP3K20, MAP3K15, MAP3K5 HIF1A 3135/4885EPAS1 574/4885PARP1 1385/4885
US-20050020583-A1 Amino-phthalazinone derivatives active as kinase inhibitors, process for their preparation and pharmaceutical compositions containing them MAP3K20, MAP3K1, MAP3K15 HIF1A 2178/4885EPAS1 564/4885PARP1 1467/4885

“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.