Fluorobenzene

Fluorobenzene

SCHEMBL4593189

Fc1ccccc1.Fc1ccccc1C(Cl)(Cl)c1nnn[nH]1

nearest known ligand 0.33

Full drug profile on Sugi Atlas →

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
KCNN4 O15554 5/20 0.33
KCNE1 P15382 1/20 0.33
KCNQ1 P51787 1/20 0.33
MLNR O43193 1/20 0.33
NR1I2 O75469 1/20 0.33
ADORA3 P0DMS8 1/20 0.33
TBXA2R P21731 1/20 0.33
CCKBR P32239 1/20 0.33
OPRK1 P41145 1/20 0.33
SLC6A3 Q01959 1/20 0.33
KCNH2 Q12809 1/20 0.33
NR1H4 Q96RI1 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
Benzene SCHEMBL4593432 0.75 TSHR (0.38)
SCHEMBL4470018 0.70 KCNN4 (0.41) KCNN4KCNE1KCNQ1MLNRNR1I2
Chlorobenzene SCHEMBL4593782 0.69 TSHR (0.35)
Bromobenzene SCHEMBL4593844 0.68 ALDH1A1 (0.34)
SCHEMBL11862432 0.68 KCNN4 (0.51) KCNN4KCNE1KCNQ1MLNRNR1I2
SCHEMBL11861229 0.67 KCNN4 (0.48) KCNN4KCNE1KCNQ1MLNRNR1I2
Diphenylether SCHEMBL4592882 0.67 LTA4H (0.36)
Toluene SCHEMBL4592876 0.65 KIF11 (0.35) KCNH2
SCHEMBL198144 0.64 KCNN4 (0.32) KCNN4
SCHEMBL11865400 0.64 KIF11 (0.41) KCNN4KCNE1KCNQ1MLNRNR1I2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1937257-A1 NOVEL ANTIBIOTICS COMPRISING BIS(1-ARYL-5-TETRAZ0LYL)METHANE DERIVATIVES Nederlandse Organisatie voor toegepast- natuurwetenschappelijk onderzoek TNO (NL) 2008-07-02 EP claimed
WO-2007037685-A1 NOVEL ANTIBIOTICS COMPRISING BIS(1-ARYL-5-TETRAZ0LYL)METHANE DERIVATIVES NEDERLANDSE ORGANISATIE VOOR TOEGEPAST-NATUURWETENSCHAPPELIJK ONDERZOEK TNO (NL) 2007-04-05 WO claimed