Phenol

Phenol

SCHEMBL28345445

C=CC(=O)NCc1ccccc1.Oc1ccccc1

nearest known ligand 0.60

Full drug profile on Sugi Atlas →

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MMP1 P03956 4/20 0.60
MMP2 P08253 4/20 0.60
MMP9 P14780 4/20 0.60
TGM2 P21980 2/20 0.60
ALDH1A1 P00352 3/20 0.57
CYP2C19 P33261 2/20 0.57
LMNA P02545 1/20 0.57
CYP2D6 P10635 1/20 0.57
CYP2C9 P11712 2/20 0.53
TRPV1 Q8NER1 1/20 0.49
CYP3A4 P08684 1/20 0.47
GAA P10253 1/20 0.47
MEN1 O00255 1/20 0.47
KMT2A Q03164 1/20 0.47
SMN1; SMN2 Q16637 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
SCHEMBL40744 0.93 TGM2 (0.68) MMP1MMP2MMP9TGM2ALDH1A1
Ethylene SCHEMBL6400166 0.91 TGM2 (0.66) MMP1MMP2MMP9TGM2ALDH1A1
Dimethylamine SCHEMBL1263583 0.88 TGM2 (0.62) MMP1MMP2MMP9TGM2ALDH1A1
SCHEMBL124217 0.87 TGM2 (0.71) MMP1MMP2MMP9TGM2ALDH1A1
Acrylamide SCHEMBL28802284 0.86 TGM2 (0.60) MMP1MMP2MMP9TGM2ALDH1A1
SCHEMBL8838968 0.86 TGM2 (0.60) MMP1MMP2MMP9TGM2ALDH1A1
SCHEMBL1119154 0.85 MMP1 (0.55) MMP1MMP2MMP9TGM2ALDH1A1
Diethylamine SCHEMBL1263580 0.83 TGM2 (0.57) MMP1MMP2MMP9TGM2ALDH1A1
SCHEMBL11775423 0.83 TGM2 (0.71) MMP1MMP2MMP9TGM2ALDH1A1
Thiophene SCHEMBL28891798 0.83 TGM2 (0.57) MMP1MMP2MMP9TGM2ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110520128-A Compositions and methods for treating complications and diseases associated with von Willebrand factor BAND THERAPEUTICS LLC 2019-11-29 CN disclosed