SCHEMBL5862489

SCHEMBL5862489

N=C(NCCCC(=O)O)S(=O)O

nearest known ligand 0.50

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PRMT1 Q99873 1/20 0.45
ATM Q13315 1/20 0.43
ADRA1A P35348 1/20 0.42
HTT P42858 1/20 0.40
PLA2G4A P47712 1/20 0.40
LMNA P02545 4/20 0.39
EPHX2 P34913 2/20 0.39
SLC22A6 Q4U2R8 1/20 0.39
FABP4 P15090 1/20 0.39
MAPK1 P28482 1/20 0.38
TSHR P16473 2/20 0.37
NFKB1 P19838 1/20 0.37
PMP22 Q01453 1/20 0.37
CYP1A2 P05177 1/20 0.37
CYP2C9 P11712 1/20 0.37
CYP2C19 P33261 1/20 0.37

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
SCHEMBL5862662 0.92 PRMT1 (0.57) PRMT1ADRA1APLA2G4ALMNAEPHX2
SCHEMBL5862617 0.88 ECE1 (0.42) PRMT1ADRA1AHTTLMNA
SCHEMBL15372584 0.74 PRMT1 (0.46) PRMT1ATMADRA1APLA2G4ALMNA
SCHEMBL5863035 0.74 EGLN1 (0.37) LMNASLC22A6TSHR
SCHEMBL31372702 0.72 PRMT1 (0.50) PRMT1ATMADRA1APLA2G4ALMNA
SCHEMBL33717 0.72 PRMT1 (0.50) PRMT1ATMADRA1APLA2G4ALMNA
SCHEMBL10002699 0.72 PRMT1 (0.54) PRMT1ATMADRA1AHTTPLA2G4A
Hydrochloric Acid SCHEMBL8613561 0.71 PRMT1 (0.48) PRMT1ATMADRA1APLA2G4ALMNA
SCHEMBL320940 0.71 PRMT1 (0.58) PRMT1ATMADRA1AHTTPLA2G4A
SCHEMBL31475480 0.71 PRMT1 (0.81) PRMT1ADRA1ALMNAEPHX2SLC22A6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7070770-B1 Compositions for the permanent deformation of the hair comprising at least one formamidinesulphinic acid derivative L'OREAL S.A. (FR) 2006-07-04 US claimed
US-7070770-B1 Compositions for the permanent deformation of the hair comprising at least one formamidinesulphinic acid derivative L'OREAL S.A. (FR) 2006-07-04 US disclosed
EP-1349534-A2 COMPOSITION FOR THE PERMANENT DEFORMATION OF THE HAIR COMPRISING AT LEAST ONE FORMAMIDINESULPHINIC ACID DERIVATIVE l'Oreal SA (FR) 2003-10-08 EP disclosed
WO-2002039965-A2 COMPOSITION FOR THE PERMANENT DEFORMATION OF THE HAIR COMPRISING AT LEAST ONE FORMAMIDINESULPHINIC ACID DERIVATIVE L'OREAL SA (FR) 2002-05-23 WO disclosed