Pentachlorophenol

Pentachlorophenol

SCHEMBL9832236

CCC(=O)Oc1ccccc1O.OCC(O)C(O)CO.Oc1c(Cl)c(Cl)c(Cl)c(Cl)c1Cl

nearest known ligand 0.35

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Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 3/20 0.35
JAK2 O60674 1/20 0.35
LMNA P02545 1/20 0.35
MAPT P10636 1/20 0.35
ELANE P08246 1/20 0.35
KMT2A Q03164 4/20 0.34
ALDH1A1 P00352 3/20 0.34
HPGD P15428 3/20 0.33
TSHR P16473 2/20 0.33
CA1 P00915 2/20 0.33
L3MBTL1 Q9Y468 2/20 0.33
CA2 P00918 1/20 0.33
TP53 P04637 1/20 0.33
POLB P06746 1/20 0.33
ALOX15 P16050 1/20 0.33
NPC1 O15118 1/20 0.33
RAB9A P51151 1/20 0.33
KDM4E B2RXH2 2/20 0.33
USP2 O75604 1/20 0.33
GLA P06280 1/20 0.33

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
E968 SCHEMBL9832239 0.90 GAA (0.42) GAAJAK2LMNAMAPTELANE
E968 SCHEMBL11207505 0.90 GAA (0.42) GAAJAK2LMNAMAPTELANE
SCHEMBL361508 0.81 GAA (0.50) GAAJAK2LMNAMAPTELANE
Methane SCHEMBL10713153 0.80 GAA (0.48) GAAJAK2LMNAMAPTELANE
SCHEMBL9008288 0.76 GAA (0.42) GAAJAK2LMNAMAPTELANE
SCHEMBL67780 0.73 ALOX15 (0.50) LMNAMAPTELANEKMT2AALDH1A1
SCHEMBL8435546 0.71 ALOX15 (0.55) MAPTELANEKMT2AALDH1A1HPGD
Pentachlorophenol SCHEMBL18039457 0.71 CYP1A2 (0.48) LMNAMAPTKMT2AALDH1A1HPGD
SCHEMBL9799609 0.70 ELANE (0.46) MAPTELANEKMT2AALDH1A1HPGD
SCHEMBL578720 0.70 ELANE (0.46) MAPTELANEKMT2AALDH1A1HPGD

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
EP-0217149-B1 POLY(2,2,6,6-TETRAMETHYLPIPERIDYLAMINOSPIROGLYCOLETHER-1,3,5-TRIAZINES) ADEKA ARGUS CHEMICAL CO., Ltd. (JP) 1991-01-30 EP disclosed