SCHEMBL263015

SCHEMBL263015

N=C(N)NCCCC(N)(N)C(=O)O

nearest known ligand 0.40

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 1/20 0.40
MEN1 O00255 1/20 0.39
CYP1A2 P05177 1/20 0.39
KMT2A Q03164 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
ALB P02768 1/20 0.32
ARG1 P05089 2/20 0.30
ARG2 P78540 1/20 0.30
TSHR P16473 1/20 0.30
HIF1A Q16665 1/20 0.30

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
SCHEMBL27751170 0.85 ALOX15 (0.40) ALOX15MEN1CYP1A2KMT2ASMN1; SMN2
SCHEMBL161929 0.81 ARG1 (0.47) ALOX15MEN1CYP1A2KMT2ASMN1; SMN2
SCHEMBL6431682 0.81 ARG1 (0.47) ALOX15MEN1CYP1A2KMT2ASMN1; SMN2
SCHEMBL7277920 0.81 ALOX15 (0.38) ALOX15MEN1CYP1A2KMT2ASMN1; SMN2
SCHEMBL28637035 0.81 ALOX15 (0.38) ALOX15MEN1CYP1A2KMT2ASMN1; SMN2
SCHEMBL202490 0.81 ARG1 (0.47) ALOX15MEN1CYP1A2KMT2ASMN1; SMN2
SCHEMBL3692819 0.81 ALOX15 (0.35) ALOX15MEN1CYP1A2KMT2ASMN1; SMN2
SCHEMBL23094075 0.80 ODC1 (0.44) ALOX15MEN1CYP1A2KMT2ASMN1; SMN2
Hydrochloric Acid SCHEMBL11674300 0.80 ARG1 (0.46) ALOX15MEN1CYP1A2KMT2ASMN1; SMN2
SCHEMBL23094070 0.80 ODC1 (0.44) ALOX15MEN1CYP1A2KMT2ASMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112740045-A Markers for the risk of developing insulin resistance in childhood and adolescence 雀巢产品有限公司 2021-04-30 CN disclosed
EP-2000474-B1 METHOD FOR PRODUCTION OF PEPTIDE THIOESTER COMPOUND GLYTECH INC (JP) 2017-11-01 EP disclosed
US-20150197500-A1 NO-RELEASING GUANIDINE-CHROMENE CONJUGATES EUCLISES PHARMACEUTICALS INC (US) 2015-07-16 US disclosed
US-20140322160-A1 METHOD AND COMPOSITION FOR ALTERING A B CELL MEDIATED PATHOLOGY MMRGLOBAL, INC. (US) 2014-10-30 US disclosed
US-8637638-B2 Method and composition for altering a B cell mediated pathology MMRGLOBAL, INC. (US) 2014-01-28 US disclosed
EP-1309347-B1 METHOD AND COMPOSITION FOR ALTERING A B CELL MEDIATED PATHOLOGY MMRGLOBAL INC (US) 2013-02-27 EP disclosed
US-20120114593-A1 METHOD AND COMPOSITION FOR ALTERING A B CELL MEDIATED PATHOLOGY MMR GLOBAL, INC. (US) 2012-05-10 US disclosed
US-8133486-B2 Method and composition for altering a B cell mediated pathology MMRGLOBAL, INC. (US) 2012-03-13 US disclosed
US-8114404-B2 Method and composition for altering a B cell mediated pathology MMRGLOBAL, INC. (US) 2012-02-14 US disclosed
US-8058394-B2 Method for production of peptide thioester compound OTSUKA CHEMICAL CO., LTD. (JP) 2011-11-15 US disclosed
US-20030082178-A1 Administering chimera protein MMRGLOBAL, INC. 2003-05-01 US disclosed
EP-1294901-A2 NOVEL PROTEASES Sugen, Inc. (US) 2003-03-26 EP disclosed
US-20030012782-A1 Method and composition for altering a T cell mediated pathology FAVRILLE, INC. 2003-01-16 US disclosed
US-20020064856-A1 Novel proteases SUGEN, INC. 2002-05-30 US disclosed
WO-2002013861-A2 METHOD AND COMPOSITION FOR ALTERING A T CELL MEDIATED PATHOLOGY FAVRILLE, INC. (US) 2002-02-21 WO disclosed
WO-2002000860-A2 NOVEL PROTEASES SUGEN, INC. (US) 2002-01-03 WO disclosed
WO-2001083782-A2 NOVEL PROTEASES SUGEN, INC. (US) 2001-11-08 WO disclosed
US-5604094-A GENETIC ENGINEERED POLYNUCLEOTIDE NEW YORK UNIVERSITY (US) 1997-02-18 US disclosed
EP-0277561-B1 NEW ARGININE DERIVATIVE, PROCESS FOR THE PREPARATION THEREOF AND ITS USE IN PEPTIDE SYNTHESIS ENIRICERCHE S.p.A. (IT) 1992-04-15 EP disclosed
EP-0277561-A1 New arginine derivative, process for the preparation thereof and its use in peptide synthesis ENIRICERCHE S.p.A. (IT) 1988-08-10 EP 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-20150197500-A1 NO-RELEASING GUANIDINE-CHROMENE CONJUGATES ARG1, ARGLU1, CGAS ALOX15 1979/4885MEN1 1271/4885CYP1A2 540/4885

“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.