SCHEMBL1555152

SCHEMBL1555152

CC(C)(Br)C(=O)Nc1ccccc1O

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 5/20 0.54
HTT P42858 3/20 0.54
LMNA P02545 2/20 0.54
MAPT P10636 2/20 0.54
NPC1 O15118 4/20 0.52
TP53 P04637 2/20 0.52
KMT2A Q03164 3/20 0.51
KDM4E B2RXH2 1/20 0.51
TDP1 Q9NUW8 1/20 0.51
MEN1 O00255 2/20 0.47
CETP P11597 1/20 0.47
PDK1 Q15118 3/20 0.46
PDK2 Q15119 3/20 0.46
PDK3 Q15120 3/20 0.46
PDK4 Q16654 3/20 0.46
RAB9A P51151 3/20 0.46
HPGD P15428 1/20 0.45
METAP2 P50579 1/20 0.45
MMP1 P03956 1/20 0.45
MMP2 P08253 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
SCHEMBL8023112 0.88 CETP (0.53) HTTNPC1CETPPDK1PDK2
SCHEMBL8243174 0.86 CETP (0.62) GAAHTTLMNAMAPTNPC1
SCHEMBL27997031 0.84 GAA (0.50) GAAHTTLMNAMAPTNPC1
SCHEMBL19280535 0.81 PDK1 (0.68) GAAHTTLMNAMAPTNPC1
SCHEMBL10027976 0.80 LMNA (0.59) GAAHTTLMNAMAPTNPC1
SCHEMBL18458382 0.79 PDK1 (0.68) GAAHTTLMNAMAPTNPC1
SCHEMBL6351755 0.79 PDK1 (0.71) GAAHTTLMNAMAPTPDK1
SCHEMBL7299817 0.78 GAA (0.56) GAAHTTLMNAMAPTNPC1
SCHEMBL30797039 0.77 PDK1 (0.50) HTTLMNANPC1KMT2AMEN1
SCHEMBL4675699 0.77 PDK1 (0.50) HTTLMNANPC1KMT2AMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240391922-A1 PYRROLOPYRROLE COMPOSITIONS AS PYRUVATE KINASE (PKR) ACTIVATORS Novo Nordisk Heathcare AG (CH) 2024-11-28 US disclosed
US-12071440-B2 Pyrrolopyrrole compositions as pyruvate kinase (PKR) activators NOVO NORDISK HEALTH CARE AG (CH) 2024-08-27 US disclosed
US-20240083901-A1 PYRROLOPYRROLE COMPOSITIONS AS PYRUVATE KINASE (PKR) ACTIVATORS NOVO NORDISK HEALTH CARE AG (CH) 2024-03-14 US disclosed
US-11649242-B2 Pyrrolopyrrole compositions as pyruvate kinase (PKR) activators FORMA THERAPEUTICS, INC. (US) 2023-05-16 US disclosed
US-11649242-B2 Pyrrolopyrrole compositions as pyruvate kinase (PKR) activators FORMA THERAPEUTICS, INC. (US) 2023-05-16 US disclosed
US-11649242-B2 Pyrrolopyrrole compositions as pyruvate kinase (PKR) activators FORMA THERAPEUTICS, INC. (US) 2023-05-16 US disclosed
US-RE49080-E1 Glycoside derivatives and uses thereof NOVARTIS AG (CH) 2022-05-24 US disclosed
CN-113456634-A Pyrrolopyrrole compositions as Pyruvate Kinase (PKR) activators 福马治疗股份有限公司 2021-10-01 CN disclosed
US-20210246143-A1 PYRROLOPYRROLE COMPOSITIONS AS PYRUVATE KINASE (PKR) ACTIVATORS NOVO NORDISK HEALTH CARE AG, (CH) 2021-08-12 US disclosed
CN-109311897-B Pyrrolopyrrole compositions as Pyruvate Kinase (PKR) activators 福马治疗股份有限公司 2021-07-20 CN disclosed
US-20110171159-A1 Glycoside Derivatives and Uses Thereof NOVARTIS AG (CH) 2011-07-14 US disclosed
WO-2011048148-A2 GLYCOSIDE DERIVATIVE AND USES THEREOF NOVARTIS AG (CH) 2011-04-28 WO disclosed
WO-2011048112-A1 GLYCOSIDE DERIVATIVES AND USES THEREOF NOVARTIS AG (CH) 2011-04-28 WO disclosed
EP-1750704-B1 UREA ANTAGONISTS OF P2Y1 RECEPTOR USEFUL IN THE TREATMENT OF THROMBOTIC CONDITIONS BRISTOL MYERS SQUIBB CO (US) 2009-07-22 EP disclosed
US-7550499-B2 Urea antagonists of P2Y1 receptor useful in the treatment of thrombotic conditions BRISTOL-MYERS SQUIBB COMPANY (US) 2009-06-23 US disclosed
EP-1985297-A1 CARBOXYLIC ACID COMPOUND AND USE THEREOF Japan Tobacco, Inc. (JP) 2008-10-29 EP disclosed
US-20070197512-A1 Carboxylic Acid Compounds and Use Thereof JAPAN TOBACCO INC. (JP) 2007-08-23 US disclosed
EP-1750704-A2 UREA ANTAGONISTS OF P2Y1 RECEPTOR USEFUL IN THE TREATMENT OF THROMBOTIC CONDITIONS Bristol-Myers Squibb Company (US) 2007-02-14 EP disclosed
WO-2005113537-A2 UREA ANTAGONISTS OF P2Y1 RECEPTOR USEFUL IN THE TREATMENT OF THROMBOTIC CONDITIONS BRISTOL-MYERS SQUIBB COMPANY (US) 2005-12-01 WO disclosed
US-20050261244-A1 Urea antagonists of P2Y1 receptor useful in the treatment of thrombotic conditions BRISTOL-MYERS SQUIBB COMPANY 2005-11-24 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 (8 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-20240391922-A1 PYRROLOPYRROLE COMPOSITIONS AS PYRUVATE KINASE (PKR) ACTIVATORS PDK1, PKM, PKLR GAA 651/4885HTT 1043/4885LMNA 2219/4885
US-12071440-B2 Pyrrolopyrrole compositions as pyruvate kinase (PKR) activators PDK1, PKM, PKLR GAA 651/4885HTT 1043/4885LMNA 2219/4885
US-20240083901-A1 PYRROLOPYRROLE COMPOSITIONS AS PYRUVATE KINASE (PKR) ACTIVATORS PDK1, PKM, PKLR GAA 651/4885HTT 1043/4885LMNA 2219/4885
US-20210246143-A1 PYRROLOPYRROLE COMPOSITIONS AS PYRUVATE KINASE (PKR) ACTIVATORS PDK1, PKM, PKLR GAA 651/4885HTT 1043/4885LMNA 2219/4885
US-20110171159-A1 Glycoside Derivatives and Uses Thereof SLC5A1, SLC5A2, SLC2A1 GAA 145/4885HTT 1370/4885LMNA 3972/4885
US-20070197512-A1 Carboxylic Acid Compounds and Use Thereof GLS, SLC10A1, SOAT1 GAA 783/4885HTT 772/4885LMNA 4136/4885
US-20050261244-A1 Urea antagonists of P2Y1 receptor useful in the treatment of thrombotic conditions P2RY1, P2RY11, P2RY2 GAA 2434/4885HTT 1607/4885LMNA 3730/4885
US-11649242-B2 Pyrrolopyrrole compositions as pyruvate kinase (PKR) activators PDK1, PKM, PKLR GAA 651/4885HTT 1043/4885LMNA 2219/4885

“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.