Phenol

Phenol

SCHEMBL28300096

Cc1cc([N+](=O)[O-])cc([N+](=O)[O-])c1.Oc1ccccc1

nearest known ligand 0.61

Full drug profile on Sugi Atlas →

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
TSHR P16473 4/20 0.61
ALDH1A1 P00352 4/20 0.53
ACHE P22303 2/20 0.53
ALOX15 P16050 1/20 0.53
LMNA P02545 3/20 0.48
ALOX5 P09917 4/20 0.46
CES2 O00748 1/20 0.46
CES1 P23141 1/20 0.46
GPR35 Q9HC97 2/20 0.46
MEN1 O00255 2/20 0.46
KMT2A Q03164 2/20 0.46
HTT P42858 1/20 0.46
HSD17B10 Q99714 1/20 0.45
ATM Q13315 1/20 0.44
KDM4E B2RXH2 1/20 0.44
MAPT P10636 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
CYP19A1 P11511 1/20 0.43

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 SCHEMBL27815806 0.90 TSHR (0.63) TSHRALDH1A1ALOX15LMNAALOX5
Phenol SCHEMBL28180162 0.88 ALDH1A1 (0.61) TSHRALDH1A1ALOX15LMNAALOX5
Dinitrophenylene SCHEMBL27485738 0.82 ALDH1A1 (0.77) TSHRALDH1A1ACHEALOX15LMNA
Trinitrotoluene SCHEMBL28045308 0.82 ALDH1A1 (0.54) TSHRALDH1A1ALOX15LMNACES2
SCHEMBL635130 0.82 TSHR (0.90) TSHRALDH1A1ACHELMNAGPR35
Phenol SCHEMBL27520174 0.81 ALDH1A1 (0.53) TSHRALDH1A1ALOX15LMNAALOX5
Dinitrophenylene SCHEMBL28179781 0.81 ALDH1A1 (0.74) TSHRALDH1A1ACHEALOX15LMNA
SCHEMBL5201173 0.80 TSHR (0.71) TSHRALDH1A1ACHEALOX15LMNA
Phenol SCHEMBL27289891 0.80 ALDH1A1 (0.68) TSHRALDH1A1ACHEALOX15LMNA
Nitrobenzene SCHEMBL27355218 0.80 ALDH1A1 (0.76) TSHRALDH1A1ALOX15LMNACES2

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-109791129-A Improved low thermal mass GC module 珀金埃尔默健康科学有限公司 2019-05-21 CN disclosed