Chlorobenzene

Chlorobenzene

SCHEMBL9625713

COC(=S)NN.Clc1ccccc1.NNC(O)=S

nearest known ligand 0.41

Full drug profile on Sugi Atlas →

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.41
KDM4E B2RXH2 4/20 0.39
MAPT P10636 4/20 0.39
IDO1 P14902 1/20 0.39
LMNA P02545 3/20 0.37
ALDH1A1 P00352 2/20 0.37
NOX1 Q9Y5S8 1/20 0.37
GAA P10253 2/20 0.34
OGG1 O15527 1/20 0.34
MEN1 O00255 2/20 0.34
KMT2A Q03164 2/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.33
RAB9A P51151 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
SCHEMBL6692143 0.79 ALDH1A1 (0.35) ALDH1A1
Methane SCHEMBL7549086 0.77 ALDH1A1 (0.33) ALDH1A1
Chlorobenzene SCHEMBL27839844 0.76 TSHR (0.52) TSHRKDM4EMAPTIDO1LMNA
1,4-Dichlorobenzene SCHEMBL9627205 0.74 MAPT (0.50) KDM4EMAPTIDO1LMNAALDH1A1
1,2-Dichlorobenzene SCHEMBL9625745 0.73 ALDH1A1 (0.40) TSHRKDM4EMAPTIDO1LMNA
SCHEMBL1384304 0.72
Chlorobenzene SCHEMBL28732785 0.70 TSHR (0.65) TSHRMAPTLMNAALDH1A1NOX1
Chlorobenzene SCHEMBL27862981 0.70 TSHR (0.65) TSHRMAPTLMNAALDH1A1NOX1
Chlorobenzene SCHEMBL27702792 0.70 TSHR (0.50) TSHRKDM4EMAPTLMNAALDH1A1
Chlorobenzene SCHEMBL28097396 0.70 TSHR (0.50) TSHRMAPTLMNAALDH1A1MEN1

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
US-5095024-A Parasiticides BAYER AKTIENGESELLSCHAFT (DE) 1992-03-10 US disclosed