Phenol

Phenol

SCHEMBL8944344

O=[N+]([O-])c1cc(Cl)c(O)cc1OCCO.Oc1ccccc1

nearest known ligand 0.42

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 2/20 0.42
RAB9A P51151 2/20 0.42
RECQL P46063 1/20 0.42
S1PR4 O95977 1/20 0.40
CYP11B1 P15538 2/20 0.40
CYP11B2 P19099 2/20 0.40
CRHBP P24387 1/20 0.38
CRHR2 Q13324 1/20 0.38
TDP1 Q9NUW8 3/20 0.38
TSHR P16473 1/20 0.38
ALDH1A1 P00352 4/20 0.38
CYP3A4 P08684 2/20 0.38
IDO1 P14902 1/20 0.38
MAPT P10636 5/20 0.37
KMT2A Q03164 3/20 0.37
SMN1; SMN2 Q16637 3/20 0.37
KDM4E B2RXH2 2/20 0.37
MEN1 O00255 2/20 0.37
PKM P14618 2/20 0.37
HTT P42858 2/20 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
SCHEMBL8944334 0.91 S1PR4 (0.43) NPC1RAB9ARECQLS1PR4TDP1
SCHEMBL11414367 0.78 TSHR (0.43) NPC1RAB9ARECQLTDP1TSHR
SCHEMBL10885884 0.77 MERTK (0.46) NPC1RAB9ARECQLS1PR4TDP1
SCHEMBL10744505 0.75 CTSV (0.50) NPC1RAB9ARECQLCYP11B1CYP11B2
SCHEMBL6815549 0.75 MAPT (0.49) NPC1RAB9AS1PR4TDP1TSHR
SCHEMBL10884859 0.74 TSHR (0.48) NPC1RAB9ARECQLS1PR4CYP11B1
SCHEMBL8944451 0.74 NPC1 (0.49) NPC1RAB9ARECQLCYP11B1CYP11B2
SCHEMBL3351038 0.73 PIN1 (0.49) NPC1RAB9ACYP11B1CYP11B2MAPT
SCHEMBL5098363 0.73 S1PR4 (0.50) NPC1RAB9ARECQLS1PR4CYP11B1
SCHEMBL6814271 0.72 MAPT (0.47) NPC1RAB9AS1PR4ALDH1A1CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5503640-A ALKYLTHIO PARA-AMINOPHENOLS IN AQUEOUS VEHICLE FOR DYEING HUMAN HAIR L'OREAL (FR) 1996-04-02 US disclosed
US-5364413-A Oxidation color dyes for hair L'OREAL (FR) 1994-11-15 US disclosed
US-5084067-A Indoaniline dyes for hair dyes L'OREAL (FR) 1992-01-28 US disclosed