SCHEMBL6380455

SCHEMBL6380455

CCCCCCCC(NC(=N)N)NC(CCCCCCC)NC(=N)N

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SPHK1 Q9NYA1 3/20 0.42
SPHK2 Q9NRA0 1/20 0.42
LMNA P02545 2/20 0.38
GPR84 Q9NQS5 4/20 0.36
CYP2D6 P10635 2/20 0.36
GMNN O75496 1/20 0.36
POLB P06746 1/20 0.36
THPO P40225 1/20 0.36
MTOR P42345 1/20 0.36
BLM P54132 1/20 0.36
KDM4E B2RXH2 1/20 0.36
TP53 P04637 1/20 0.36
CYP1A2 P05177 1/20 0.36
CYP3A4 P08684 1/20 0.36
MAPT P10636 1/20 0.36
CETP P11597 1/20 0.36
HTT P42858 1/20 0.36
UBE2N P61088 1/20 0.36
LAP3 P28838 1/20 0.36
OPRM1 P35372 1/20 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
SCHEMBL28977889 0.92 SPHK1 (0.45) SPHK1SPHK2LMNAGPR84CYP2D6
SCHEMBL4536662 0.92 SPHK1 (0.45) SPHK1SPHK2LMNAGPR84CYP2D6
Acetic Acid SCHEMBL1123274 0.92 GPR84 (0.42) GPR84MAPTFFAR4FFAR1FAAH
Hydrochloric Acid SCHEMBL3722897 0.90 SPHK1 (0.43) SPHK1SPHK2LMNAGPR84CYP2D6
SCHEMBL4896937 0.90 SPHK1 (0.41) SPHK1SPHK2LMNAGPR84CYP2D6
Acetic Acid SCHEMBL11113366 0.84 CNR2 (0.45) GPR84MAPTFFAR4FFAR1FAAH
SCHEMBL13587256 0.80 ADH1B (0.47) SPHK1SPHK2LMNACYP2D6GMNN
SCHEMBL22209352 0.80 SPHK1 (0.45) SPHK1SPHK2LMNAGPR84CYP2D6
SCHEMBL1068405 0.80 ADH1B (0.47) SPHK1SPHK2LMNACYP2D6GMNN
SCHEMBL13725523 0.80 ADH1B (0.47) SPHK1SPHK2LMNACYP2D6GMNN

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1051289-B1 PROTECTIVE AGENTS FOR WOOD LONZA AG (CH) 2005-10-05 EP disclosed
EP-1097031-B1 AGENTS AND METHOD FOR THE PROTECTIVE TREATMENT OF WOOD LONZA AG (CH) 2003-11-05 EP disclosed
US-6362370-B1 QUATERNARY AMMONIUM SALTS WITH CARBOXYLIC ACIDS CONTAINING AT LEAST ONE HYDROXYL, AMINO OR SULPHONIC ACID GROUP; BIOCIDE; PENETRATES EASILY LONZA AG (CH) 2002-03-26 US disclosed
EP-0906177-B1 WOOD PRESERVATIVES LONZA AG (CH) 2002-03-20 EP disclosed
EP-1097031-A1 AGENTS AND METHOD FOR THE PROTECTIVE TREATMENT OF WOOD Lonza AG (CH) 2001-05-09 EP disclosed
US-6180672-B1 CONTAINING MICROBIOCIDE LONZA AG (CH) 2001-01-30 US disclosed
WO-2000002716-A1 AGENTS AND METHOD FOR THE PROTECTIVE TREATMENT OF WOOD LONZA AG (CH) 2000-01-20 WO disclosed
EP-0906177-A1 WOOD PRESERVATIVES LONZA A.G. (CH) 1999-04-07 EP disclosed
WO-1997045236-A1 WOOD PRESERVATIVES LONZA AG (CH) 1997-12-04 WO disclosed
EP-0802027-A1 Process for the antifouling protection of glued boards and boards stacked on pile Ostermann & Scheiwe GmbH & Co (DE) 1997-10-22 EP disclosed
EP-0451524-A1 Method for preparation of wood preservative agents ACIMA, Aktiengesellschaft für Chemische Industrie Im Ochsensand (CH) 1991-10-16 EP disclosed