SCHEMBL4339857

SCHEMBL4339857

O=C1NC(=O)C(c2nn(CCCO)c3ccccc23)=C1c1cn(C2CCOCC2)c2ccccc12

nearest known ligand 0.55

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
GSK3B P49841 14/20 0.55
PRKCG P05129 10/20 0.54
PRKCB P05771 10/20 0.54
PRKCA P17252 10/20 0.54
KCNH2 Q12809 2/20 0.54
PRKCD Q05655 5/20 0.49
CAMK2D Q13557 4/20 0.49
PRKCH P24723 3/20 0.49
PRKCE Q02156 3/20 0.49
PRKCZ Q05513 3/20 0.49
CAMK2B Q13554 3/20 0.49
CAMK2G Q13555 3/20 0.49
CAMK2A Q9UQM7 3/20 0.49
IDH1 O75874 1/20 0.49
SRC P12931 1/20 0.49
KISS1R Q969F8 1/20 0.48

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
SCHEMBL5757131 0.76 GSK3B (0.65) GSK3BPRKCGPRKCBPRKCAKCNH2
SCHEMBL2954384 0.76 GSK3B (0.56) GSK3BPRKCGPRKCBPRKCAKCNH2
SCHEMBL3779590 0.75 GSK3B (0.79) GSK3BPRKCGPRKCBPRKCAKCNH2
SCHEMBL3774788 0.74 GSK3B (0.80) GSK3BPRKCGPRKCBPRKCAKCNH2
SCHEMBL4677138 0.74 GSK3B (0.59) GSK3BPRKCGPRKCBPRKCAKCNH2
SCHEMBL5759900 0.74 GSK3B (0.80) GSK3BPRKCGPRKCBPRKCAKCNH2
SCHEMBL5758142 0.74 GSK3B (0.72) GSK3BPRKCGPRKCBPRKCAKCNH2
SCHEMBL3781580 0.73 GSK3B (0.66) GSK3BPRKCGPRKCBPRKCA
SCHEMBL4680645 0.73 PRKCG (0.57) GSK3BPRKCGPRKCBPRKCAPRKCD
SCHEMBL6984319 0.73 GSK3B (0.78) GSK3BPRKCGPRKCBPRKCAKCNH2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20180127723-A1 TREATMENT OF PLURIPOTENT CELLS JANSSEN BIOTECH, INC. (US) 2018-05-10 US claimed
EP-2664669-B1 TREATMENT OF PLURIPOTENT CELLS JANSSEN BIOTECH INC (US) 2017-12-27 EP claimed
US-20140080210-A1 Treatment of Pluripotent Cells JANSSEN BIOTECH, INC. (US) 2014-03-20 US claimed
US-20130337564-A1 Treatment of Pluripotent Cells JANSSEN BIOTECH, INC. 2013-12-19 US claimed
EP-2664669-A1 Treatment of pluripotent cells Janssen Biotech, Inc. (US) 2013-11-20 EP claimed
US-20090325293-A1 TREATMENT OF PLURIPOTENT CELLS JANSSEN BIOTECH, INC. 2009-12-31 US claimed
US-20180127723-A1 TREATMENT OF PLURIPOTENT CELLS JANSSEN BIOTECH, INC. (US) 2018-05-10 US disclosed
US-20180127723-A1 TREATMENT OF PLURIPOTENT CELLS JANSSEN BIOTECH, INC. (US) 2018-05-10 US disclosed
EP-2664669-B1 TREATMENT OF PLURIPOTENT CELLS JANSSEN BIOTECH INC (US) 2017-12-27 EP disclosed
EP-2664669-B1 TREATMENT OF PLURIPOTENT CELLS JANSSEN BIOTECH INC (US) 2017-12-27 EP disclosed
US-9845460-B2 Treatment of pluripotent cells JANSSEN BIOTECH, INC. (US) 2017-12-19 US disclosed
US-9845460-B2 Treatment of pluripotent cells JANSSEN BIOTECH, INC. (US) 2017-12-19 US disclosed
US-20140080210-A1 Treatment of Pluripotent Cells JANSSEN BIOTECH, INC. (US) 2014-03-20 US disclosed
US-8623648-B2 Treatment of pluripotent cells JANSSEN BIOTECH, INC. (US) 2014-01-07 US disclosed
US-8623648-B2 Treatment of pluripotent cells JANSSEN BIOTECH, INC. (US) 2014-01-07 US disclosed
EP-2664669-A1 Treatment of pluripotent cells Janssen Biotech, Inc. (US) 2013-11-20 EP disclosed
US-20090325293-A1 TREATMENT OF PLURIPOTENT CELLS JANSSEN BIOTECH, INC. 2009-12-31 US disclosed
US-20090325293-A1 TREATMENT OF PLURIPOTENT CELLS JANSSEN BIOTECH, INC. 2009-12-31 US disclosed
US-20090325293-A1 TREATMENT OF PLURIPOTENT CELLS JANSSEN BIOTECH, INC. 2009-12-31 US disclosed
WO-2009132068-A2 TREATMENT OF PLURIPOTENT CELLS CENTOCOR ORTHO BIOTECH INC. (US) 2009-10-29 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 (1 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-20180127723-A1 TREATMENT OF PLURIPOTENT CELLS GSK3B, GSK3A, GSKIP GSK3B 1/4885PRKCG 104/4885PRKCB 61/4885

“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.