SCHEMBL322071

SCHEMBL322071

COc1ncc(Br)cc1C(F)(F)F

nearest known ligand 0.42

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
SSTR4 P31391 1/20 0.42
AURKA O14965 2/20 0.41
KDR P35968 2/20 0.41
AURKB Q96GD4 2/20 0.41
ULK1 O75385 1/20 0.38
CYP11B1 P15538 3/20 0.35
CYP11B2 P19099 3/20 0.35
PIK3CA P42336 2/20 0.34
PIK3R1 P27986 1/20 0.34
S100A9 P06702 1/20 0.34
NOTUM Q6P988 2/20 0.33
MTOR P42345 1/20 0.33
DYRK1B Q9Y463 1/20 0.32
CFTR P13569 3/20 0.32
S1PR4 O95977 1/20 0.32

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
SCHEMBL30851311 1.00 SSTR4 (0.42) SSTR4AURKAKDRAURKBULK1
SCHEMBL22437230 0.87 SSTR4 (0.36) SSTR4AURKAKDRAURKBULK1
SCHEMBL29749337 0.83 SSTR4 (0.44) SSTR4AURKAKDRAURKBULK1
SCHEMBL22638138 0.83 SSTR4 (0.44) SSTR4AURKAKDRAURKBULK1
SCHEMBL2391289 0.82 SSTR4 (0.46) SSTR4CYP11B1CYP11B2NOTUMCFTR
SCHEMBL21513137 0.81 AAK1 (0.35) SSTR4AURKAKDRAURKBCYP11B1
SCHEMBL2414662 0.81 SSTR4 (0.40) SSTR4AURKAKDRAURKBULK1
SCHEMBL2713610 0.80 SSTR4 (0.49) SSTR4CYP11B1CYP11B2S1PR4
SCHEMBL13281923 0.80 SSTR4 (0.52) SSTR4AURKAKDRAURKBCYP11B1
SCHEMBL5942469 0.79 AURKA (0.42) SSTR4AURKAKDRAURKBULK1

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 106 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4656636-A1 CRYSTAL FORM AND USE OF PARP 7 INHIBITOR AND SALT THEREOF QILU PHARMACEUTICAL CO., LTD. (CN) 2025-12-03 EP disclosed
EP-4644385-A1 TIPARP INHIBITOR COMPOUNDS AbbVie Inc. (US) 2025-11-05 EP disclosed
US-20250333394-A1 Tiparp Inhibitor Compounds ABBVIE INC. (US) 2025-10-30 US disclosed
US-20250059181-A1 Tetrahydro-Pyrido-Pyrimidine Derivatives NOVARTIS AG (CH) 2025-02-20 US disclosed
US-20240351997-A1 NOVEL PARP7 INHIBITOR AND USE THEREOF SHANGHAI QILU PHARMACEUTICAL RESEARCH AND DEVELOPMENT CENTRE LTD. (CN) 2024-10-24 US disclosed
WO-2024156286-A1 CRYSTAL FORM AND USE OF PARP 7 INHIBITOR AND SALT THEREOF 齐鲁制药有限公司 2024-08-02 WO disclosed
WO-2024149378-A1 QUINOLINONE COMPOUND AND NAPHTHYRIDINONE COMPOUND AND USE THEREOF 上海超阳药业有限公司 2024-07-18 WO disclosed
EP-4378938-A1 NOVEL PARP7 INHIBITOR AND USE THEREOF Shanghai Qilu Pharmaceutical Research and Development Centre Ltd. (CN) 2024-06-05 EP disclosed
CN-118084936-A Three-ring-containing compound and application thereof 石药集团中奇制药技术(石家庄)有限公司 2024-05-28 CN disclosed
CN-117777099-A PARP7 inhibitors and uses thereof 诺沃斯达药业(上海)有限公司 2024-03-29 CN disclosed
WO-2013088404-A1 Use of inhibitors of the activity or function of PI3K NOVARTIS AG (CH) 2013-06-20 WO disclosed
WO-2013088404-A1 Use of inhibitors of the activity or function of PI3K NOVARTIS AG (CH) 2013-06-20 WO disclosed
EP-2590974-A1 TETRAHYDRO-PYRIDO-PYRIMIDINE DERIVATIVES Novartis AG (CH) 2013-05-15 EP disclosed
WO-2013057711-A1 QUINAZOLINE DERIVATIVES AS PI3K MODULATORS NOVARTIS AG (CH) 2013-04-25 WO disclosed
WO-2013001445-A1 SOLID FORMS AND SALTS OF TETRAHYDRO-PYRIDO-PYRIMIDINE DERIVATIVES NOVARTIS AG (CH) 2013-01-03 WO disclosed
US-20120065183-A1 Tetrahydro-Pyrido-Pyrimidine Derivatives NOVARTIS AG (CH) 2012-03-15 US disclosed
US-20120065183-A1 Tetrahydro-Pyrido-Pyrimidine Derivatives NOVARTIS AG (CH) 2012-03-15 US disclosed
US-20120065183-A1 Tetrahydro-Pyrido-Pyrimidine Derivatives NOVARTIS AG (CH) 2012-03-15 US disclosed
WO-2012004299-A1 TETRAHYDRO-PYRIDO-PYRIMIDINE DERIVATIVES NOVARTIS AG (CH) 2012-01-12 WO disclosed
WO-2012004299-A1 TETRAHYDRO-PYRIDO-PYRIMIDINE DERIVATIVES NOVARTIS AG (CH) 2012-01-12 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 (4 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-20250059181-A1 Tetrahydro-Pyrido-Pyrimidine Derivatives PIK3CA, TYMP, TYMS SSTR4 3869/4885AURKA 2107/4885KDR 1064/4885
US-20120065183-A1 Tetrahydro-Pyrido-Pyrimidine Derivatives PIK3CA, TYMP, TYMS SSTR4 3869/4885AURKA 2107/4885KDR 1064/4885
US-20250333394-A1 Tiparp Inhibitor Compounds TIPARP, TIPRL, TPP1 SSTR4 4679/4885AURKA 1751/4885KDR 3895/4885
US-20240351997-A1 NOVEL PARP7 INHIBITOR AND USE THEREOF PARP6, PARP4, PARP3 SSTR4 4853/4885AURKA 496/4885KDR 2469/4885

“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.