Phenol

Phenol

SCHEMBL3849573

CCCCCCCC[N+](C)(CCCCCCCC)CCCCCCCC.[O-]c1ccccc1

nearest known ligand 0.53

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DNM1 Q05193 9/20 0.53
MEN1 O00255 2/20 0.51
KMT2A Q03164 2/20 0.51
MAPK1 P28482 2/20 0.51
SMN1; SMN2 Q16637 2/20 0.51
TP53 P04637 1/20 0.51
HTT P42858 4/20 0.50
MLNR O43193 1/20 0.47
NR1I2 O75469 1/20 0.47
ESR1 P03372 1/20 0.47
NR3C1 P04150 1/20 0.47
PGR P06401 1/20 0.47
ADRB2 P07550 1/20 0.47
CHRM2 P08172 1/20 0.47
ADRB1 P08588 1/20 0.47
HTR1A P08908 1/20 0.47
ADRA2A P08913 1/20 0.47
ADORA3 P0DMS8 1/20 0.47
CHRM1 P11229 1/20 0.47
DRD2 P14416 1/20 0.47

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
Phenol SCHEMBL3852355 1.00 DNM1 (0.53) DNM1MEN1KMT2AMAPK1SMN1; SMN2
Phenol SCHEMBL3857882 1.00 DNM1 (0.53) DNM1MEN1KMT2AMAPK1SMN1; SMN2
Tributylmethylammonium SCHEMBL6468591 0.92 DNM1 (0.43) DNM1MEN1KMT2AMAPK1SMN1; SMN2
Cetrimonium SCHEMBL8007042 0.89 DNM1 (0.58) DNM1MEN1KMT2AMAPK1SMN1; SMN2
Phenol SCHEMBL3860436 0.88 SLC22A1 (0.54) DNM1MEN1KMT2AMAPK1SMN1; SMN2
Tetrapentylammonium SCHEMBL7931037 0.86 SLC22A1 (0.52) DNM1MEN1KMT2AMAPK1SMN1; SMN2
Toluene SCHEMBL9743031 0.82 DNM1 (0.55) DNM1MEN1KMT2AMAPK1SMN1; SMN2
Tetrabuthylammonium SCHEMBL887137 0.82 SLC22A1 (0.52) DNM1MEN1KMT2AMAPK1SMN1; SMN2
Toluene SCHEMBL6154400 0.81 MEN1 (0.56) DNM1MEN1KMT2AMAPK1SMN1; SMN2
Cetrimonium SCHEMBL28222832 0.80 DNM1 (0.47) DNM1MEN1KMT2AMAPK1SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7578971-B2 methyltricaprylylammonium phenoxide as phase transfer agent, pH sensitive color indicator is thymol blue, and ethoxylated alcohol is octylphenol ethoxylate; polyethersulfone as a solid support; excellent resistance to humidity; located in an esophageal breathing system MERCURY ENTERPRISES, INC. (US) 2009-08-25 US claimed
US-20060216828-A1 Rapid-response reversible dry surface CO2 detector MERCURY ENTERPRISE, INC. 2006-09-28 US claimed
US-7578971-B2 methyltricaprylylammonium phenoxide as phase transfer agent, pH sensitive color indicator is thymol blue, and ethoxylated alcohol is octylphenol ethoxylate; polyethersulfone as a solid support; excellent resistance to humidity; located in an esophageal breathing system MERCURY ENTERPRISES, INC. (US) 2009-08-25 US disclosed
US-20060216828-A1 Rapid-response reversible dry surface CO2 detector MERCURY ENTERPRISE, INC. 2006-09-28 US disclosed
EP-0363428-B1 CONVERSION OF PYRETHROID ISOMERS TO MORE ACTIVE SPECIES FMC CORP (US) 1995-08-09 EP disclosed
US-4997970-A Slurrying, isomerization with catalyst FMC CORPORATION (US) 1991-03-05 US disclosed
EP-0363428-A1 CONVERSION OF PYRETHROID ISOMERS TO MORE ACTIVE SPECIES. FMC CORP (US) 1990-04-18 EP disclosed
WO-1988010249-A1 CONVERSION OF PYRETHROID ISOMERS TO MORE ACTIVE SPECIES FMC CORPORATION (US) 1988-12-29 WO disclosed