SCHEMBL7048982

SCHEMBL7048982

CCCCCCCCCCCCCCCCC(C)(C)C(N)O

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SPHK1 Q9NYA1 2/20 0.43
FDPS P14324 8/20 0.41
LMNA P02545 3/20 0.41
CYP2D6 P10635 2/20 0.41
SMPD1 P17405 2/20 0.41
GMNN O75496 1/20 0.41
POLB P06746 1/20 0.41
THPO P40225 1/20 0.41
MTOR P42345 1/20 0.41
BLM P54132 1/20 0.41
KDM4E B2RXH2 1/20 0.41
TP53 P04637 1/20 0.41
CYP1A2 P05177 1/20 0.41
CYP3A4 P08684 1/20 0.41
MAPT P10636 1/20 0.41
CETP P11597 1/20 0.41
HTT P42858 1/20 0.41
UBE2N P61088 1/20 0.41
ALDH1A1 P00352 1/20 0.40
HSD17B10 Q99714 1/20 0.40

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
SCHEMBL11219203 1.00 SPHK1 (0.43) SPHK1FDPSLMNACYP2D6SMPD1
SCHEMBL5885255 0.91 SPHK1 (0.37) SPHK1FDPSLMNACYP2D6GMNN
SCHEMBL12514661 0.81 LMNA (0.43) SPHK1FDPSLMNAALDH1A1HSD17B10
SCHEMBL158353 0.81 LMNA (0.43) SPHK1FDPSLMNAALDH1A1HSD17B10
SCHEMBL10582326 0.81 LMNA (0.43) SPHK1FDPSLMNACYP2D6SMPD1
SCHEMBL28738508 0.80
SCHEMBL8897150 0.79 LMNA (0.42) SPHK1FDPSLMNAALDH1A1HSD17B10
SCHEMBL9817670 0.79 OPRM1 (0.42) SPHK1FDPSLMNASMPD1ALDH1A1
SCHEMBL6322458 0.79 LMNA (0.42) SPHK1FDPSLMNAALDH1A1HSD17B10
SCHEMBL1660093 0.79 LMNA (0.42) SPHK1FDPSLMNAALDH1A1HSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0848628-B1 PROCESS USING A PERACID COMPOSITION FOR DECONTAMINATING MATERIALS CONTAMINATED WITH TOXIC AGENTS FRANCE ETAT (FR) 2003-04-23 EP claimed
EP-0848628-A1 PERACID COMPOSITION FOR DECONTAMINATING MATERIALS CONTAMINATED WITH TOXIC AGENTS ETAT-FRANCAIS représenté par le DELEGUE GENERAL POUR L'ARMEMENT (DPAG) (FR) 1998-06-24 EP claimed
WO-1997033655-A1 PERACID COMPOSITION FOR DECONTAMINATING MATERIALS CONTAMINATED WITH TOXIC AGENTS ETAT FRANÇAIS représenté par le DELEGUE GENERAL POUR L'ARMEMENT (FR) 1997-09-18 WO claimed
EP-0848628-B1 PROCESS USING A PERACID COMPOSITION FOR DECONTAMINATING MATERIALS CONTAMINATED WITH TOXIC AGENTS FRANCE ETAT (FR) 2003-04-23 EP disclosed
EP-0848628-A1 PERACID COMPOSITION FOR DECONTAMINATING MATERIALS CONTAMINATED WITH TOXIC AGENTS ETAT-FRANCAIS représenté par le DELEGUE GENERAL POUR L'ARMEMENT (DPAG) (FR) 1998-06-24 EP disclosed
WO-1997033655-A1 PERACID COMPOSITION FOR DECONTAMINATING MATERIALS CONTAMINATED WITH TOXIC AGENTS ETAT FRANÇAIS représenté par le DELEGUE GENERAL POUR L'ARMEMENT (FR) 1997-09-18 WO disclosed