SCHEMBL1968196

SCHEMBL1968196

Cc1ccc(CC(N)CN)nc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NOS3 P29474 1/20 0.41
NOS2 P35228 1/20 0.41
CCR1 P32246 1/20 0.39
CCR5 P51681 1/20 0.39
CCR8 P51685 1/20 0.39
HDAC6 Q9UBN7 1/20 0.39
CXCR4 P61073 3/20 0.36
ADRA2A P08913 2/20 0.34
ADRA2B P18089 2/20 0.34
ADRA2C P18825 2/20 0.34
PLAU P00749 1/20 0.34
ESR1 P03372 1/20 0.34
ESR2 Q92731 1/20 0.34
PDE10A Q9Y233 1/20 0.33
CPB2 Q96IY4 2/20 0.32
TLR7 Q9NYK1 1/20 0.32
DAO P14920 1/20 0.32
SYK P43405 1/20 0.31
AURKB Q96GD4 1/20 0.31
INCENP Q9NQS7 1/20 0.31

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
SCHEMBL20031861 0.85 NOS3 (0.41) NOS3NOS2CCR1CCR5CCR8
SCHEMBL20278941 0.81 NOS3 (0.37) NOS3NOS2CCR1CCR5CCR8
SCHEMBL5673173 0.79 HRH3 (0.43) ESR1ESR2MAPTRAB9A
SCHEMBL6126149 0.76 CCR1 (0.44) NOS3NOS2CCR1CCR5CCR8
SCHEMBL29452043 0.76
SCHEMBL1631010 0.76
Hydrochloric Acid SCHEMBL13732444 0.74 NOS3 (0.48) NOS3NOS2CCR1CCR5CCR8
Hydrochloric Acid SCHEMBL6444667 0.74 NOS3 (0.48) NOS3NOS2CCR1CCR5CCR8
SCHEMBL12128833 0.74 CYP1A2 (0.47) NOS3NOS2KEAP1NFE2L2
SCHEMBL13957329 0.74 CYP1A2 (0.47) NOS3NOS2KEAP1NFE2L2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2038356-B8 LIQUID HARDENING UNILEVER PLC (GB) 2011-06-22 EP claimed
EP-2038356-A1 LIQUID HARDENING Unilever PLC (GB) 2009-03-25 EP claimed
WO-2008003652-A1 LIQUID HARDENING UNILEVER PLC (GB) 2008-01-10 WO claimed
CN-113474383-B Free radical polymerizable composition 波林复合材料美国股份有限公司 2023-10-31 CN disclosed
CN-109476953-B Desiccant composition for alkyd resins 湛新奥地利有限公司 2021-12-24 CN disclosed
US-11193038-B2 Drier compositions for alkyd resins ALLNEX AUSTRIA GMBH (AT) 2021-12-07 US disclosed
CN-113474383-A Radically polymerizable composition 波林复合材料美国股份有限公司 2021-10-01 CN disclosed
EP-2760899-B1 COATING COMPOSITION AND USE THEREOF PPG EUROPE B V (NL) 2020-08-19 EP disclosed
US-20190309185-A1 DRIER COMPOSITIONS FOR ALKYD RESINS ALLNEX AUSTRIA GMBH (AT) 2019-10-10 US disclosed
US-20180334549-A1 DRIER COMPOSITION AND USE THEREOF PPG EUROPE BV (NL) 2018-11-22 US disclosed
EP-2652025-B1 DRIER COMPOSITION AND USE THEREOF PPG EUROPE B V (NL) 2018-08-22 EP disclosed
WO-2001064827-A1 COMPOSITION AND METHOD FOR BLEACHING A SUBSTRATE UNILEVER PLC (GB) 2001-09-07 WO 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-2001064825-A1 BLEACHING COMPOSITION AND METHOD FOR BLEACHING LAUNDRY FABRICS UNILEVER PLC (GB) 2001-09-07 WO disclosed
WO-2001048138-A2 BLEACHING COMPOSITION UNILEVER N.V. (NL) 2001-07-05 WO disclosed
WO-2001048137-A1 BLEACHING COMPOSITION UNILEVER N.V. (NL) 2001-07-05 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