SCHEMBL28876980

SCHEMBL28876980

FCNc1ccc(Cl)cc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.48
KMT2A Q03164 2/20 0.48
CNR2 P34972 1/20 0.44
CYP1A2 P05177 2/20 0.42
CYP2C9 P11712 2/20 0.42
CYP2C19 P33261 2/20 0.42
NPC1 O15118 2/20 0.42
RECQL P46063 1/20 0.42
RAB9A P51151 1/20 0.42
LMNA P02545 1/20 0.42
CYP2A6 P11509 1/20 0.42
ALDH1A1 P00352 1/20 0.41
CYP2D6 P10635 1/20 0.41
HPGD P15428 1/20 0.41
GFER P55789 1/20 0.41
IDO1 P14902 1/20 0.39
HDAC1 Q13547 1/20 0.39
FFAR1 O14842 1/20 0.39
GAA P10253 1/20 0.39
MAPT P10636 1/20 0.39

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
SCHEMBL9639726 0.83 MAPT (0.55) MEN1KMT2ACNR2CYP1A2CYP2C9
SCHEMBL3029679 0.82 MEN1 (0.47) MEN1KMT2ACNR2CYP1A2CYP2C9
SCHEMBL1801536 0.80 NR1I2 (0.56) MEN1KMT2ACNR2CYP1A2CYP2C9
SCHEMBL632439 0.79 CNR2 (0.48) MEN1KMT2ACNR2CYP1A2CYP2C9
SCHEMBL1947326 0.77 MEN1 (0.47) MEN1KMT2ACNR2CYP1A2CYP2C9
Hydrochloric Acid SCHEMBL1924678 0.77 CNR2 (0.47) MEN1KMT2ACNR2CYP1A2CYP2C9
SCHEMBL7793228 0.77 SMN1; SMN2 (0.56) MEN1KMT2ACNR2CYP1A2RAB9A
SCHEMBL28576825 0.76 CNR2 (0.46) MEN1KMT2ACNR2CYP1A2CYP2C9
SCHEMBL296404 0.75 HPGD (0.46) MEN1KMT2ANPC1LMNAALDH1A1
SCHEMBL4155501 0.75 MEN1 (0.46) MEN1KMT2ACYP1A2CYP2C9CYP2C19

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-110343057-A A kind of synthetic method of Hexanaphthene flusulfamide 长沙理工大学 2019-10-18 CN claimed