Phenylmethanesulfonic Acid

Phenylmethanesulfonic Acid

SCHEMBL6913609

CCCCCCCCCCCC[N+](CCCCCCCCCCCC)(CCCCCCCCCCCC)CCCCCCCCCCCC.O=S(=O)([O-])Cc1ccccc1

nearest known ligand 0.50

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DNM1 Q05193 2/20 0.50
MEN1 O00255 3/20 0.49
KMT2A Q03164 3/20 0.49
TP53 P04637 1/20 0.49
MAPK1 P28482 1/20 0.49
SMN1; SMN2 Q16637 1/20 0.49
HTT P42858 3/20 0.47
LMNA P02545 1/20 0.42
CYP2D6 P10635 1/20 0.42
CYP2C9 P11712 1/20 0.42
TSHR P16473 1/20 0.42
CYP2C19 P33261 1/20 0.42
KCNH2 Q12809 1/20 0.42
HIF1A Q16665 1/20 0.42
ALDH1A1 P00352 1/20 0.42
HPGD P15428 1/20 0.42
CNR2 P34972 1/20 0.42
SLC22A1 O15245 1/20 0.42
EPHX2 P34913 1/20 0.41
PKM P14618 1/20 0.41

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
Tetrabuthylammonium SCHEMBL1718182 0.95 DNM1 (0.44) DNM1MEN1KMT2ATP53MAPK1
Phenylmethanesulfonic Acid SCHEMBL10966375 0.94 DNM1 (0.53) DNM1MEN1KMT2ATP53MAPK1
Tetrabuthylammonium SCHEMBL9450297 0.94 DNM1 (0.42) DNM1MEN1KMT2ATP53MAPK1
Phenylmethanesulfonic Acid SCHEMBL3187399 0.91 DNM1 (0.51) DNM1MEN1KMT2ATP53MAPK1
Cetrimonium SCHEMBL25264815 0.91 DNM1 (0.51) DNM1MEN1KMT2ATP53MAPK1
Phenylmethanesulfonic Acid SCHEMBL30557743 0.88 DNM1 (0.56) DNM1MEN1KMT2ATP53MAPK1
Sulfuric Acid SCHEMBL11812332 0.84 DNM1 (0.58) DNM1MEN1KMT2ATP53MAPK1
Phenylmethanesulfonic Acid SCHEMBL5081849 0.83 HTT (0.46) DNM1MEN1KMT2ATP53MAPK1
Phenylmethanesulfonic Acid SCHEMBL9812428 0.83 ALDH1A1 (0.41) DNM1MEN1KMT2ATP53MAPK1
Phenylmethanesulfonic Acid SCHEMBL4464878 0.83 CNR2 (0.44) DNM1MEN1KMT2AHTTKCNH2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6727294-B2 RADIATION TRANSPARENT MOLDING MATERIALS MITSUBISHI ENGINEERING-PLASTICS CORPORATION (JP) 2004-04-27 US disclosed
US-20010034419-A1 Radiation transparent molding materials MITSUBISHI ENGINEERING-PLASTICS CORPORATION (JP) 2001-10-25 US disclosed