SCHEMBL5070960

SCHEMBL5070960

O=C(c1ccc(Nc2nccc(-c3ccc(Cl)cc3)n2)cc1)N1CCC(N2CCCC2)CC1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
IKBKB O14920 10/20 0.64
CHUK O15111 10/20 0.64
IKBKG Q9Y6K9 10/20 0.64
MEN1 O00255 1/20 0.64
RECQL P46063 1/20 0.64
BLM P54132 1/20 0.64
KMT2A Q03164 1/20 0.64
PRKCZ Q05513 1/20 0.64
TDP1 Q9NUW8 1/20 0.64
JAK2 O60674 2/20 0.54
JAK1 P23458 2/20 0.54
JAK3 P52333 2/20 0.54
SYK P43405 2/20 0.53
MBTD1 Q05BQ5 4/20 0.52
L3MBTL3 Q96JM7 4/20 0.52
L3MBTL1 Q9Y468 3/20 0.52
TP53BP1 Q12888 1/20 0.52
L3MBTL4 Q8NA19 1/20 0.52
PIK3CA P42336 1/20 0.51
PIK3CB P42338 1/20 0.51

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
SCHEMBL8247959 0.99 IKBKB (0.63) IKBKBCHUKIKBKGMEN1RECQL
SCHEMBL14063722 0.93 IKBKB (0.56) IKBKBCHUKIKBKGMEN1RECQL
SCHEMBL14021292 0.93 IKBKB (0.56) IKBKBCHUKIKBKGMEN1RECQL
SCHEMBL8312503 0.91 IKBKB (0.56) IKBKBCHUKIKBKGMEN1RECQL
SCHEMBL8312320 0.90 IKBKB (0.53) IKBKBCHUKIKBKGMEN1RECQL
SCHEMBL14021190 0.90 MTOR (0.60) IKBKBCHUKIKBKGMEN1RECQL
SCHEMBL11924733 0.90 MTOR (0.60) IKBKBCHUKIKBKGMEN1RECQL
SCHEMBL8254568 0.89 JAK2 (0.55) IKBKBCHUKIKBKGMEN1RECQL
SCHEMBL14021219 0.89 PIK3CA (0.58) IKBKBCHUKIKBKGJAK2JAK1
SCHEMBL11924743 0.88 GRM5 (0.60) IKBKBCHUKIKBKGMEN1RECQL

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170327788-A1 COMPOSITION FOR COLLECTING AND PRESERVING PLACENTAL STEM CELLS AND METHODS OF USING THE COMPOSITION ANTHROGENESIS CORPORATION (US) 2017-11-16 US disclosed
US-20170327788-A1 COMPOSITION FOR COLLECTING AND PRESERVING PLACENTAL STEM CELLS AND METHODS OF USING THE COMPOSITION ANTHROGENESIS CORPORATION (US) 2017-11-16 US disclosed
US-9725694-B2 Composition for collecting and preserving placental stem cells and methods of using the composition ANTHROGENESIS CORPORATION (US) 2017-08-08 US disclosed
US-9725694-B2 Composition for collecting and preserving placental stem cells and methods of using the composition ANTHROGENESIS CORPORATION (US) 2017-08-08 US disclosed
US-9598669-B2 Composition for collecting placental stem cells and methods of using the composition ANTHROGENESIS CORPORATION (US) 2017-03-21 US disclosed
US-9598669-B2 Composition for collecting placental stem cells and methods of using the composition ANTHROGENESIS CORPORATION (US) 2017-03-21 US disclosed
US-20150313881-A1 Therapeutic Methods for Type I Diabetes UNIVERSITY OF MASSACHUSETTS 2015-11-05 US disclosed
US-20150313881-A1 Therapeutic Methods for Type I Diabetes UNIVERSITY OF MASSACHUSETTS 2015-11-05 US disclosed
US-8501812-B2 Therapeutic methods for type I diabetes UNIVERSITY OF MASSACHUSETTS (US) 2013-08-06 US disclosed
US-8501812-B2 Therapeutic methods for type I diabetes UNIVERSITY OF MASSACHUSETTS (US) 2013-08-06 US disclosed
US-20070270448-A1 Methods of Using and Compositions Comprising a Jnk Inhibitor for the Treatment and Management of Asbestos-Related Diseases and Disorders CELGENE CORPORATION (US) 2007-11-22 US disclosed
US-20070270448-A1 Methods of Using and Compositions Comprising a Jnk Inhibitor for the Treatment and Management of Asbestos-Related Diseases and Disorders CELGENE CORPORATION (US) 2007-11-22 US disclosed
EP-1827422-A2 JNK INHIBITORS FOR THE TREATMENT OF CNS INJURY CELGENE CORPORATION (US) 2007-09-05 EP disclosed
US-20070190042-A1 Composition for collecting and preserving placental stem cells and methods of using the composition Celularity, Inc. 2007-08-16 US disclosed
US-20070190042-A1 Composition for collecting and preserving placental stem cells and methods of using the composition Celularity, Inc. 2007-08-16 US disclosed
WO-2006104983-A1 THERAPEUTIC METHODS FOR TYPE I DIABETES UNIVERSITY OF MASSACHUSETTS MEDICAL SCHOOL (US) 2006-10-05 WO disclosed
WO-2006058007-A2 JNK INHIBITORS FOR TREATMENT OF CNS INJURY CELGENE CORPORATION (US) 2006-06-01 WO disclosed
WO-2004084901-A1 METHODS FOR TREATING OR PREVENTING AN INFLAMMATORY OR METABOLIC CONDITION BY INHIBITING JNK SIGNAL PHARMACEUTICALS, LLC (US) 2004-10-07 WO disclosed
US-20040087642-A1 Methods of using and compositions comprising a JNK inhibitor for the treatment, prevention, management and/or modification of pain CELGENE CORPORATION 2004-05-06 US disclosed
US-20040087642-A1 Methods of using and compositions comprising a JNK inhibitor for the treatment, prevention, management and/or modification of pain CELGENE CORPORATION 2004-05-06 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 (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-20040087642-A1 Methods of using and compositions comprising a JNK inhibitor for the treatment, prevention, management and/or modification of pain MAP3K1, MAP3K6, MAPKAPK2 IKBKB 110/4885CHUK 58/4885IKBKG 182/4885
US-20150313881-A1 Therapeutic Methods for Type I Diabetes MAPK9, IAPP, RNASE1 IKBKB 755/4885CHUK 433/4885IKBKG 1907/4885
US-20070190042-A1 Composition for collecting and preserving placental stem cells and methods of using the composition PGF, ALPP, CPA1 IKBKB 2300/4885CHUK 2428/4885IKBKG 2374/4885
US-20070270448-A1 Methods of Using and Compositions Comprising a Jnk Inhibitor for the Treatment and Management of Asbestos-Related Diseases and Disorders MAP3K6, MAP3K1, MAPK1 IKBKB 89/4885CHUK 44/4885IKBKG 697/4885

“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.