SCHEMBL44336

SCHEMBL44336

CCN1CCNCCNCC1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CXCR4 P61073 7/20 0.44
POLB P06746 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
MEN1 O00255 1/20 0.39
CHRM2 P08172 1/20 0.39
CHRM1 P11229 1/20 0.39
ADRA2C P18825 1/20 0.39
CCR2 P41597 1/20 0.39
CXCL12 P48061 1/20 0.39
BLM P54132 1/20 0.39
KMT2A Q03164 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
HRH3 Q9Y5N1 1/20 0.39
SIGMAR1 Q99720 2/20 0.38
TSHR P16473 1/20 0.38
CHRM5 P08912 1/20 0.38
CHRM3 P20309 1/20 0.38
LMNA P02545 1/20 0.36
HSD17B10 Q99714 1/20 0.35
PDE4A P27815 2/20 0.35

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
SCHEMBL8516481 1.00 CXCR4 (0.44) CXCR4POLBSMN1; SMN2MEN1CHRM2
SCHEMBL11602430 1.00 CXCR4 (0.44) CXCR4POLBSMN1; SMN2MEN1CHRM2
Piperazine SCHEMBL27357188 1.00 CXCR4 (0.44) CXCR4POLBSMN1; SMN2MEN1CHRM2
SCHEMBL1332129 0.97
SCHEMBL152746 0.97 SMN1; SMN2 (0.42) CXCR4POLBSMN1; SMN2MEN1CHRM2
SCHEMBL5943 0.97
SCHEMBL447924 0.97
SCHEMBL8154731 0.94 SMN1; SMN2 (0.41) CXCR4POLBSMN1; SMN2SIGMAR1TSHR
SCHEMBL3999578 0.94 SMN1; SMN2 (0.41) CXCR4POLBSMN1; SMN2SIGMAR1TSHR
SCHEMBL3995950 0.94 SMN1; SMN2 (0.41) CXCR4POLBSMN1; SMN2SIGMAR1TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3176155-B1 1,2-BIS-(4,7-DIMETHYL-1,4,7-TRIAZACYCLONON-1-YL)-ETHANE AND INTERMEDIATE FOR THE SYNTHESIS OF SAME CATEXEL LTD (GB) 2019-09-25 EP claimed
WO-2012003599-A1 METHODS FOR THE SYNTHESIS OF BIS (TRIAZACYCLONONANE) LIGANDS UNILEVER PLC (GB) 2012-01-12 WO claimed
EP-3891264-A1 LOW pH POWDER DETERGENT COMPOSITION Novozymes A/S (DK) 2021-10-13 EP disclosed
WO-2020251947-A1 CATHETER INSERT DEVICES THE REGENTS OF THE UNIVERSITY OF MICHIGAN (US) 2020-12-17 WO disclosed
WO-2020114965-A1 LOW pH POWDER DETERGENT COMPOSITION NOVOZYMES A/S (DK) 2020-06-11 WO disclosed
WO-2020102820-A1 COMPOUNDS FOR USE AS IRON (III) MRI CONTRAST AGENTS CONTAINING ANIONIC PENDENTS AND ANCILLARY GROUPS THE RESEARCH FOUNDATION FOR THE STATE UNIVERSITY OF NEW YORK (US) 2020-05-22 WO disclosed
WO-2012003599-A1 METHODS FOR THE SYNTHESIS OF BIS (TRIAZACYCLONONANE) LIGANDS UNILEVER PLC (GB) 2012-01-12 WO disclosed
EP-1341893-B1 ENZYMATIC DETERGENT COMPOSITIONS UNILEVER NV (NL) 2007-05-02 EP disclosed
EP-1208186-B1 COMPOSITION AND METHOD FOR BLEACHING A SUBSTRATE UNILEVER PLC (GB) 2006-05-10 EP disclosed
EP-1160267-B1 CATALYST FOR OXIDATIVE POLYMERIZATION OF FLUOROPHENOL, METHOD OF OXIDATIVE POLYMERIZATION OF FLUOROPHENOL, AND POLY(OXYFLUOROPHENYLENE) DERIVATIVE JAPAN SCIENCE & TECH CORP (JP) 2004-08-04 EP disclosed
US-6646122-B1 Triazacyclohenonane ligand UNILEVER HOME & PERSONAL CARE USA, DIVISION OF CONOPCO, INC. 2003-11-11 US disclosed
EP-1259522-B1 LIGAND AND COMPLEX FOR CATALYTICALLY BLEACHING A SUBSTRATE UNILEVER PLC (GB) 2003-09-10 EP disclosed
US-6610641-B2 Transition metal complex UNILEVER HOME & PERSONAL CARE USA, DIVISION OF CONOPCO, INC. 2003-08-26 US disclosed
US-20030050211-A1 Enzymatic detergent compositions UNILEVER HOME & PERSONAL CARE USA, DIVISION OF CONOPCO, INC. 2003-03-13 US disclosed
EP-1259588-A2 COMPOSITION AND METHOD FOR BLEACHING A SUBSTRATE UNILEVER PLC (GB) 2002-11-27 EP disclosed
US-20020137654-A1 Enzymatic detergent compositions UNILEVER HOME & PERSONAL CARE USA, DIVISION OF CONOPCO, INC. 2002-09-26 US disclosed
US-6432900-B1 ANTISOILANTS UNILEVER HOME & PERSONAL CARE USA, DIVISION OF CONOPCO, INC. 2002-08-13 US disclosed
WO-2002048307-A1 ENZYMATIC DETERGENT COMPOSITIONS UNILEVER N.V. (NL) 2002-06-20 WO disclosed
US-20020010120-A1 Composition and method for bleaching a substrate UNILEVER HOME & PERSONAL CARE USA, DIVISION OF CONOPCO, INC. 2002-01-24 US disclosed
WO-2001064826-A2 COMPOSITION AND METHOD FOR BLEACHING A SUBSTRATE UNILEVER PLC (GB) 2001-09-07 WO disclosed