SCHEMBL86937

SCHEMBL86937

COc1cccc2c(=O)[nH]nc(Cc3ccc(F)c(C(=O)O)c3)c12

nearest known ligand 0.56

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
PARP1 P09874 19/20 0.56
CYP3A4 P08684 1/20 0.52
CYP2C9 P11712 1/20 0.52
TSHR P16473 1/20 0.52
CYP2C19 P33261 1/20 0.52
PRAP1 Q96NZ9 1/20 0.51
TNKS O95271 1/20 0.49
TNKS2 Q9H2K2 1/20 0.49

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
SCHEMBL30595385 1.00 PARP1 (0.56) PARP1CYP3A4CYP2C9TSHRCYP2C19
SCHEMBL29082758 0.91 PARP1 (0.53) PARP1CYP3A4CYP2C9TSHRCYP2C19
SCHEMBL76627 0.87 PARP1 (0.74) PARP1PRAP1TNKSTNKS2
SCHEMBL78100 0.85 PARP1 (0.65) PARP1PRAP1TNKSTNKS2
SCHEMBL87269 0.85 PARP1 (0.59) PARP1TNKSTNKS2
SCHEMBL4183468 0.83 PARP1 (0.79) PARP1PRAP1TNKSTNKS2
SCHEMBL87122 0.82 CYP3A4 (0.52) PARP1CYP3A4CYP2C9TSHRCYP2C19
SCHEMBL29466162 0.82 PARP1 (0.70) PARP1TNKSTNKS2
SCHEMBL29403857 0.82 PARP1 (0.70) PARP1TNKSTNKS2
SCHEMBL78452 0.82 PARP1 (0.70) PARP1TNKSTNKS2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116803990-A Preparation method of Olaparib 天津法莫西医药科技有限公司 2023-09-26 CN claimed
CN-116803990-A Preparation method of Olaparib 天津法莫西医药科技有限公司 2023-09-26 CN disclosed
CN-116803990-A Preparation method of Olaparib 天津法莫西医药科技有限公司 2023-09-26 CN disclosed
US-20120129855-A1 PHTHALAZINONE DERIVATIVES MENEAR KEITH ALLAN (GB) 2012-05-24 US disclosed
US-20120129855-A1 PHTHALAZINONE DERIVATIVES MENEAR KEITH ALLAN (GB) 2012-05-24 US disclosed
US-20120129855-A1 PHTHALAZINONE DERIVATIVES MENEAR KEITH ALLAN (GB) 2012-05-24 US disclosed
US-8129380-B2 Phthalazinone derivatives ASTRAZENECA AB (SE) 2012-03-06 US disclosed
US-8129380-B2 Phthalazinone derivatives ASTRAZENECA AB (SE) 2012-03-06 US disclosed
EP-2231638-A1 PHTHALAZINONE DERIVATIVES AstraZeneca AB (SE) 2010-09-29 EP disclosed
US-20090192156-A1 PHTHALAZINONE DERIVATIVES KUDOS PHARMACEUTICALS LIMITED (GB) 2009-07-30 US disclosed
US-20090192156-A1 PHTHALAZINONE DERIVATIVES KUDOS PHARMACEUTICALS LIMITED (GB) 2009-07-30 US disclosed
US-20090192156-A1 PHTHALAZINONE DERIVATIVES KUDOS PHARMACEUTICALS LIMITED (GB) 2009-07-30 US disclosed
WO-2009093032-A1 PHTHALAZINONE DERIVATIVES ASTRAZENECA AB (SE) 2009-07-30 WO disclosed
WO-2009093032-A1 PHTHALAZINONE DERIVATIVES ASTRAZENECA AB (SE) 2009-07-30 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 (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-20090192156-A1 PHTHALAZINONE DERIVATIVES CBR1, CBR3, SDHA PARP1 1973/4885CYP3A4 184/4885CYP2C9 248/4885
US-20120129855-A1 PHTHALAZINONE DERIVATIVES CBR1, CBR3, SDHA PARP1 1973/4885CYP3A4 184/4885CYP2C9 248/4885

“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.