SCHEMBL6206213

SCHEMBL6206213

CCc1ccc(CNCCN)nc1

nearest known ligand 0.46

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CXCR4 P61073 1/20 0.46
HRH3 Q9Y5N1 3/20 0.42
CYP1A2 P05177 1/20 0.41
CYP2D6 P10635 1/20 0.41
TLR7 Q9NYK1 6/20 0.41
IL6 P05231 5/20 0.41
MEN1 O00255 1/20 0.40
LMNA P02545 1/20 0.40
KMT2A Q03164 1/20 0.40
MC4R P32245 1/20 0.39
MC5R P33032 1/20 0.39
HTR1A P08908 1/20 0.38
TAAR1 Q96RJ0 1/20 0.37
S1PR3 Q99500 2/20 0.37
CHRM2 P08172 1/20 0.37
POLB P06746 1/20 0.36
STK17B O94768 1/20 0.36
STK17A Q9UEE5 1/20 0.36

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
Tromethamine SCHEMBL7143511 0.89 CXCR4 (0.39) CXCR4HRH3CYP1A2CYP2D6TLR7
SCHEMBL10484107 0.86 NFKB1 (0.44) CXCR4HRH3CYP1A2TLR7IL6
SCHEMBL10862698 0.85 HRH3 (0.48) CXCR4HRH3CYP1A2CYP2D6TAAR1
SCHEMBL17409833 0.81 TLR7 (0.46) CXCR4HRH3CYP1A2CYP2D6TLR7
SCHEMBL10483936 0.80 HRH3 (0.46) HRH3CYP1A2CYP2D6TLR7IL6
SCHEMBL4618374 0.79 NOS3 (0.39) CXCR4HTR1ACHRM2
SCHEMBL7143514 0.78 KMT2A (0.42) CXCR4HRH3CYP1A2CYP2D6MEN1
SCHEMBL19580586 0.77 HRH3 (0.47) CXCR4HRH3CYP1A2CYP2D6MEN1
SCHEMBL11627706 0.77 HRH3 (0.56) HRH3CYP1A2CYP2D6HTR1ATAAR1
SCHEMBL30707740 0.77 LMNA (0.42) CXCR4HRH3CYP1A2CYP2D6TLR7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1250693-C Bleaching composition of enhanced stability and process for making such composition UNILEVER NV (NL) 2006-04-12 CN disclosed
EP-1506277-A1 ENZYMATIC DETERGENT COMPOSITIONS UNILEVER N.V. (NL) 2005-02-16 EP disclosed
CN-1167785-C Bleaching compositions and methods for bleaching substrates 2004-09-22 CN disclosed
CN-1491276-A Bleaching compositions with enhanced stability and process for making such compositions 2004-04-21 CN disclosed
EP-1368449-A1 LIQUID CLEANING COMPOSITIONS AND THEIR USE UNILEVER N.V. (NL) 2003-12-10 EP disclosed
WO-2003097780-A1 ENZYMATIC DETERGENT COMPOSITIONS UNILEVER N.V. (NL) 2003-11-27 WO disclosed
EP-1360268-A1 BLEACHING COMPOSITION OF ENHANCED STABILITY AND A PROCESS FOR MAKING SUCH A COMPOSITION UNILEVER PLC (GB) 2003-11-12 EP disclosed
EP-1341893-A1 ENZYMATIC DETERGENT COMPOSITIONS UNILEVER N.V. (NL) 2003-09-10 EP disclosed
CN-1432059-A Targeted moieties for use in blech catalysts UNILEVER PLC (NL) 2003-07-23 CN disclosed
EP-1319061-A1 LAUNDRY BLEACHING KIT AND METHOD OF BLEACHING A SUBSTRATE UNILEVER PLC (GB) 2003-06-18 EP disclosed
WO-2001064824-A1 BLEACHING AND DYE TRANSFER INHIBITING COMPOSITION AND METHOD FOR STAIN BLEACHING OF LAUNDRY FABRICS UNILEVER PLC (GB) 2001-09-07 WO disclosed
WO-2001064828-A1 LAUNDRY BLEACHING AND DYE TRANSFER INHIBITING COMPOSITION UNILEVER PLC (GB) 2001-09-07 WO disclosed
WO-2001016269-A1 METHOD OF BLEACHING STAINED FABRICS UNILEVER PLC (GB) 2001-03-08 WO disclosed
WO-2001016268-A1 METHOD OF PRETREATING AND BLEACHING STAINED FABRICS UNILEVER PLC (GB) 2001-03-08 WO disclosed
WO-2001016271-A1 COMPOSITION AND METHOD FOR BLEACHING A SUBSTRATE UNILEVER PLC (GB) 2001-03-08 WO disclosed
US-4812571-A NITROMETHYLENE COMPOUNDS NIHON TOKUSHU NOYAKU SEIZO K.K. (JP) 1989-03-14 US disclosed
US-4774247-A Nitromethylene derivative insecticides NIHON TOKUSHU NOYAKU SEIZO K.K. (JP) 1988-09-27 US disclosed
US-4678795-A 1-pyridylmethyl-2-nitromethylene-1,3-diazacycloalkane insecticides NIHON TOKUSHU NOYAKU SEIZO K.K. (JP) 1987-07-07 US disclosed
EP-0192060-A1 Heterocyclic compounds NIHON BAYER AGROCHEM K.K. (JP) 1986-08-27 EP disclosed
EP-0163855-A1 Nitromethylene derivatives, intermediates, and process for their preparation as insecticides NIHON TOKUSHU NOYAKU SEIZO K.K. (JP) 1985-12-11 EP disclosed