SCHEMBL2191045

SCHEMBL2191045

O=C(CCl)NCCc1ccc(O)cc1

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.65
F13A1 P00488 1/20 0.65
GAA P10253 2/20 0.58
GFER P55789 2/20 0.58
NPC1 O15118 1/20 0.58
CYP1A2 P05177 1/20 0.58
CYP2D6 P10635 1/20 0.58
MAPT P10636 1/20 0.58
CYP2C19 P33261 1/20 0.58
RAB9A P51151 1/20 0.58
SMN1; SMN2 Q16637 1/20 0.58
ESRRB O95718 2/20 0.58
ESRRG P62508 2/20 0.58
TMEM97 Q5BJF2 1/20 0.52
SIGMAR1 Q99720 1/20 0.52
TRPV1 Q8NER1 1/20 0.50
PLAAT3 P53816 1/20 0.50
PLAAT5 Q96KN8 1/20 0.50
PLAAT2 Q9NWW9 1/20 0.50
PLAAT4 Q9UL19 1/20 0.50

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
SCHEMBL14370357 0.88 KDM4E (0.69) KDM4EF13A1GAAGFERNPC1
SCHEMBL2379821 0.85 KDM4E (0.65) KDM4EF13A1GAAGFERNPC1
SCHEMBL4161209 0.85 ESRRB (0.77) KDM4EF13A1GAAGFERNPC1
SCHEMBL5574769 0.85 LMNA (0.66) GAAGFERNPC1CYP1A2CYP2D6
SCHEMBL28747980 0.85 KDM4E (0.65) KDM4EF13A1GAAGFERNPC1
SCHEMBL23700596 0.83 KDM4E (0.62) KDM4EF13A1GAAGFERNPC1
SCHEMBL20052590 0.83 LMNA (0.47) KDM4EF13A1CYP1A2CYP2D6CYP2C19
SCHEMBL21377225 0.83 KDM4E (0.62) KDM4EF13A1GAAGFERNPC1
SCHEMBL6425050 0.83 KDM4E (0.62) KDM4EF13A1GAAGFERNPC1
SCHEMBL7842536 0.83 KDM4E (0.68) KDM4EF13A1GAAGFERNPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1212056-B1 METHODS AND COMPOSITIONS FOR BISUBSTRATE INHIBITORS OF ACETYLTRANSFERASES US GOV HEALTH & HUMAN SERV (US) 2005-12-07 EP claimed
EP-1212056-A1 METHODS AND COMPOSITIONS FOR BISUBSTRATE INHIBITORS OF ACETYLTRANSFERASES The Government of the United States of America, as represented by the Secretary, Department of Health and Human Services (US) 2002-06-12 EP claimed
US-20020002144-A1 Methods and compositions for bisubstrate inhibitors of acetyltransferases THE GOVERNMENT OF THE UNITED STATES OF AMERICA, DEPARTMENT OF HEALTH & HUMAN SERVICES (US) 2002-01-03 US claimed
WO-2001012185-A1 METHODS AND COMPOSITIONS FOR BISUBSTRATE INHIBITORS OF ACETYLTRANSFERASES THE GOVERNMENT OF THE UNITED STATES OF AMERICA, AS REPRESENTED BY THE SECRETARY, DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) 2001-02-22 WO claimed
EP-2341915-B1 PHOSPHORYLATED DENDRIMERS AS ANTIINFLAMMATORY DRUGS CENTRE NAT RECH SCIENT (FR) 2019-03-20 EP disclosed
EP-2341915-B1 PHOSPHORYLATED DENDRIMERS AS ANTIINFLAMMATORY DRUGS CENTRE NAT RECH SCIENT (FR) 2019-03-20 EP disclosed
US-10106565-B2 Phosphorylated dendrimers as antiinflammatory drugs CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (FR) 2018-10-23 US disclosed
US-20130336997-A1 PHOSPHORYLATED DENDRIMERS AS ANTIINFLAMMATORY DRUGS CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (FR) 2013-12-19 US disclosed
EP-2341915-A1 PHOSPHORYLATED DENDRIMERS AS ANTIINFLAMMATORY DRUGS Centre National de la Recherche Scientifique (FR) 2011-07-13 EP disclosed
US-20100173871-A1 PHOSPHORYLATED DENDRIMERS AS ANTIINFLAMMATORY DRUGS CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (FR) 2010-07-08 US disclosed
US-20100173871-A1 PHOSPHORYLATED DENDRIMERS AS ANTIINFLAMMATORY DRUGS CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (FR) 2010-07-08 US disclosed
WO-2010013086-A1 PHOSPHORYLATED DENDRIMERS AS ANTIINFLAMMATORY DRUGS CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (FR) 2010-02-04 WO disclosed
EP-1212056-B1 METHODS AND COMPOSITIONS FOR BISUBSTRATE INHIBITORS OF ACETYLTRANSFERASES US GOV HEALTH & HUMAN SERV (US) 2005-12-07 EP disclosed
EP-1212056-A1 METHODS AND COMPOSITIONS FOR BISUBSTRATE INHIBITORS OF ACETYLTRANSFERASES The Government of the United States of America, as represented by the Secretary, Department of Health and Human Services (US) 2002-06-12 EP disclosed
US-20020002144-A1 Methods and compositions for bisubstrate inhibitors of acetyltransferases THE GOVERNMENT OF THE UNITED STATES OF AMERICA, DEPARTMENT OF HEALTH & HUMAN SERVICES (US) 2002-01-03 US disclosed
WO-2001012185-A1 METHODS AND COMPOSITIONS FOR BISUBSTRATE INHIBITORS OF ACETYLTRANSFERASES THE GOVERNMENT OF THE UNITED STATES OF AMERICA, AS REPRESENTED BY THE SECRETARY, DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) 2001-02-22 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 (3 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-10106565-B2 Phosphorylated dendrimers as antiinflammatory drugs DUSP6, DUSP10, PTMS KDM4E 3952/4885F13A1 2614/4885GAA 2018/4885
US-20130336997-A1 PHOSPHORYLATED DENDRIMERS AS ANTIINFLAMMATORY DRUGS DUSP6, DUSP10, PTMS KDM4E 3952/4885F13A1 2614/4885GAA 2018/4885
US-20100173871-A1 PHOSPHORYLATED DENDRIMERS AS ANTIINFLAMMATORY DRUGS CD14, DUSP3, IRAK3 KDM4E 4254/4885F13A1 2767/4885GAA 1845/4885

“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.