SCHEMBL6890878

SCHEMBL6890878

NC(Cc1ccncc1)c1ccccn1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GRIN2D O15399 1/20 0.42
GRIN3B O60391 1/20 0.42
GRIN1 Q05586 1/20 0.42
GRIN2A Q12879 1/20 0.42
GRIN2B Q13224 1/20 0.42
GRIN2C Q14957 1/20 0.42
GRIN3A Q8TCU5 1/20 0.42
SLC6A2 P23975 4/20 0.42
SLC6A4 P31645 3/20 0.42
SLC6A3 Q01959 3/20 0.42
CYP1A2 P05177 1/20 0.41
CYP3A4 P08684 1/20 0.41
KCNA5 P22460 4/20 0.40
TSHR P16473 1/20 0.40
KCNE1 P15382 1/20 0.40
AKT1 P31749 2/20 0.39
RAD52 P43351 1/20 0.39
TAAR1 Q96RJ0 2/20 0.38
MAOA P21397 1/20 0.38
SIGMAR1 Q99720 1/20 0.38

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
SCHEMBL5570274 0.89 SLC6A2 (0.50) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL30321061 0.89 SLC6A2 (0.50) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
Hydrochloric Acid SCHEMBL9321507 0.87 SLC6A2 (0.48) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL20385358 0.83 TSHR (0.41) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL20385361 0.83 TSHR (0.41) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL5108196 0.83 TAAR1 (0.50) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL7073814 0.81 CYP1A2 (0.49) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL5263511 0.79 SLC6A4 (0.42) SLC6A2SLC6A4SLC6A3CYP1A2CYP3A4
SCHEMBL6933088 0.78 GRIN2D (0.68) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL20473311 0.76 PNMT (0.54) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B

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 14 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040038844-A1 For laundry fabrics UNILEVER HOME & PERSONAL CARE USA, DIVISION OF CONOPCO, INC. 2004-02-26 US disclosed
EP-1319061-A1 LAUNDRY BLEACHING KIT AND METHOD OF BLEACHING A SUBSTRATE UNILEVER PLC (GB) 2003-06-18 EP disclosed
EP-1283861-A1 COMPOSITION AND METHOD FOR BLEACHING A SUBSTRATE UNILEVER PLC (GB) 2003-02-19 EP disclosed
EP-1259671-A1 METHOD FOR REDUCING DYE FADING OF FABRICS IN LAUNDRY BLEACHING COMPOSITIONS UNILEVER PLC (GB) 2002-11-27 EP disclosed
EP-1208187-A1 METHOD OF BLEACHING STAINED FABRICS Unilever Plc (GB) 2002-05-29 EP disclosed
EP-1208188-A1 COMPOSITION AND METHOD FOR BLEACHING A SUBSTRATE UNILEVER PLC (GB) 2002-05-29 EP disclosed
WO-2002024852-A1 LAUNDRY BLEACHING KIT AND METHOD OF BLEACHING A SUBSTRATE UNILEVER PLC (GB) 2002-03-28 WO disclosed
EP-1165029-A1 ORAL COMPOSITION WITH AN IMPROVED TEETH WHITENING EFFECT UNILEVER N.V. (NL) 2002-01-02 EP disclosed
WO-2001064827-A1 COMPOSITION AND METHOD FOR BLEACHING A SUBSTRATE UNILEVER PLC (GB) 2001-09-07 WO disclosed
WO-2001064994-A1 METHOD FOR REDUCING DYE FADING OF FABRICS IN LAUNDRY BLEACHING COMPOSITIONS 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-2001016271-A1 COMPOSITION AND METHOD FOR BLEACHING A SUBSTRATE UNILEVER PLC (GB) 2001-03-08 WO disclosed
WO-2000059461-A1 ORAL COMPOSITION WITH AN IMPROVED TEETH WHITENING EFFECT UNILEVER N.V. (NL) 2000-10-12 WO disclosed