SCHEMBL355352

SCHEMBL355352

O=C(O)CCCCCn1c2ccccc2c(=O)c2ccccc21

nearest known ligand 0.82

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FABP4 P15090 3/20 0.82
FABP5 Q01469 3/20 0.82
FABP3 P05413 1/20 0.63
HDAC1 Q13547 4/20 0.61
HDAC6 Q9UBN7 4/20 0.61
HDAC3 O15379 1/20 0.61
HDAC4 P56524 1/20 0.61
HDAC7 Q8WUI4 1/20 0.61
HDAC2 Q92769 1/20 0.61
HDAC10 Q969S8 1/20 0.61
HDAC11 Q96DB2 1/20 0.61
HDAC8 Q9BY41 1/20 0.61
HDAC9 Q9UKV0 1/20 0.61
HDAC5 Q9UQL6 1/20 0.61
GLA P06280 1/20 0.61
SLC6A4 P31645 2/20 0.57
SLC6A2 P23975 1/20 0.57
HRH1 P35367 1/20 0.57
TBXAS1 P24557 1/20 0.53
TP53 P04637 1/20 0.52

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
SCHEMBL31156410 0.92 FABP4 (0.97) FABP4FABP5FABP3HDAC1HDAC6
SCHEMBL29114062 0.92 FABP4 (0.97) FABP4FABP5FABP3HDAC1HDAC6
SCHEMBL6833930 0.92 FABP4 (0.97) FABP4FABP5FABP3HDAC1HDAC6
SCHEMBL6419189 0.92 FABP4 (0.97) FABP4FABP5FABP3HDAC1HDAC6
SCHEMBL12951764 0.90 FABP4 (1.00) FABP4FABP5FABP3HDAC1HDAC6
SCHEMBL1415802 0.88 FABP4 (0.64) FABP4FABP5FABP3HDAC1HDAC6
SCHEMBL354562 0.88 FABP4 (0.64) FABP4FABP5FABP3HDAC1HDAC6
SCHEMBL354539 0.88 FABP4 (0.64) FABP4FABP5FABP3HDAC1HDAC6
SCHEMBL353478 0.88 FABP4 (0.64) FABP4FABP5FABP3HDAC1HDAC6
SCHEMBL353874 0.85 FABP4 (0.60) FABP4FABP5HDAC1HDAC6HDAC3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100184098-A1 METHODS FOR MEASURING ENZYME ACTIVITY GE HEALTHCARE UK LIMITED (GB) 2010-07-22 US claimed
US-7727739-B2 Methods for measuring enzyme activity GE HEALTHCARE UK LIMITED (GB) 2010-06-01 US claimed
EP-1497452-A2 METHODS FOR MEASURING ENZYME ACTIVITY Amersham Biosciences UK Limited (GB) 2005-01-19 EP claimed
US-20030228609-A1 Methods for measuring enzyme activity TTP LABTECH LIMITED (GB) 2003-12-11 US claimed
WO-2003089663-A2 METHODS FOR MEASURING ENZYME ACTIVITY AMERSHAM BIOSCIENCES UK LIMITED (GB) 2003-10-30 WO claimed
CN-108473499-B Novel pyrazolopyrimidine derivatives 诺华股份有限公司 2021-07-23 CN disclosed
US-20200289514-A1 Novel Pyrazolo Pyrimidine Derivatives NOVARTIS PHARMA AG (CH) 2020-09-17 US disclosed
US-10442808-B2 Pyrazolo pyrimidine derivatives and their use as MALT1 inhbitors NOVARTIS AG (CH) 2019-10-15 US disclosed
EP-3149001-B1 NOVEL PYRAZOLO PYRIMIDINE DERIVATIVES AND THEIR USE AS MALT1 INHIBITORS NOVARTIS AG (CH) 2019-04-24 EP disclosed
EP-3374361-A1 NOVEL PYRAZOLO PYRIMIDINE DERIVATIVES Novartis AG (CH) 2018-09-19 EP disclosed
US-20180030061-A1 NOVEL PYRAZOLO PYRIMIDINE DERIVATIVES AND THEIR USE AS MALT1 INHBITORS NOVARTIS AG (CH) 2018-02-01 US disclosed
US-9815842-B2 Pyrazolo pyrimidine derivatives and their use as MALT1 inhibitors NOVARTIS AG (CH) 2017-11-14 US disclosed
EP-1649283-A2 METHOD FOR MEASURING AROMATASE ACTIVITY GE Healthcare UK Limited (GB) 2006-04-26 EP disclosed
WO-2005012901-A2 METHOD FOR MEASURING AROMATASE ACTIVITY AMERSHAM BIOSCIENCES UK LIMITED (GB) 2005-02-10 WO disclosed
EP-1497452-A2 METHODS FOR MEASURING ENZYME ACTIVITY Amersham Biosciences UK Limited (GB) 2005-01-19 EP disclosed
US-20040191792-A1 Acridone derivatives as labels for fluorescence detection of target materials GE HEALTHCARE UK LIMITED (GB) 2004-09-30 US disclosed
EP-1392776-A2 ACRIDONE DERIVATIVES AS LABELS FOR FLUORESCENCE DETECTION OF TARGET MATERIALS Amersham Biosciences UK Limited (GB) 2004-03-03 EP disclosed
US-20030228609-A1 Methods for measuring enzyme activity TTP LABTECH LIMITED (GB) 2003-12-11 US disclosed
WO-2003089663-A2 METHODS FOR MEASURING ENZYME ACTIVITY AMERSHAM BIOSCIENCES UK LIMITED (GB) 2003-10-30 WO disclosed
WO-2002099424-A2 ACRIDONE DERIVATIVES AS LABELS FOR FLUORESCENCE DETECTION OF TARGET MATERIALS AMERSHAM BIOSCIENCES UK LIMITED (GB) 2002-12-12 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-20180030061-A1 NOVEL PYRAZOLO PYRIMIDINE DERIVATIVES AND THEIR USE AS MALT1 INHBITORS MMEL1, MALT1, FBP1 FABP4 4332/4885FABP5 3183/4885FABP3 3401/4885
US-20200289514-A1 Novel Pyrazolo Pyrimidine Derivatives MMEL1, PPME1, CTSC FABP4 4534/4885FABP5 3591/4885FABP3 3917/4885
US-20040191792-A1 Acridone derivatives as labels for fluorescence detection of target materials ACR, ARSA, H4C1; H4C2; H4C3; H4C4; H4C5; H4C6; H4C8; H4C9; H4C11; H4C12; H4C13; H4C14; H4C15; H4C16 FABP4 1027/4885FABP5 905/4885FABP3 862/4885
US-10442808-B2 Pyrazolo pyrimidine derivatives and their use as MALT1 inhbitors FBP1, MMEL1, MALT1 FABP4 4306/4885FABP5 2644/4885FABP3 3379/4885

“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.