SCHEMBL28045327

SCHEMBL28045327

[CH2]c1cc(Cl)cc([N+](=O)[O-])c1O

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GPR35 Q9HC97 8/20 0.53
TTR P02766 2/20 0.50
MAPT P10636 5/20 0.49
LMNA P02545 3/20 0.49
MEN1 O00255 2/20 0.49
KMT2A Q03164 2/20 0.49
TDP1 Q9NUW8 2/20 0.49
HTT P42858 1/20 0.49
POLB P06746 2/20 0.44
ALDH1A1 P00352 4/20 0.44
KDM4E B2RXH2 2/20 0.44
CYP1A2 P05177 1/20 0.44
CYP2C9 P11712 1/20 0.44
HPGD P15428 1/20 0.44
ALOX15 P16050 1/20 0.44
ALOX12 P18054 1/20 0.44
MAPK1 P28482 1/20 0.44
RECQL P46063 1/20 0.44
PMP22 Q01453 1/20 0.44
HIF1A Q16665 1/20 0.44

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
SCHEMBL6010796 0.86 GPR35 (0.63) GPR35TTRMAPTLMNAMEN1
SCHEMBL17295602 0.81 CYP1A2 (0.43) GPR35TTRMAPTLMNAMEN1
SCHEMBL310420 0.80 GPR35 (0.69) GPR35TTRMAPTLMNAMEN1
Niclofolan SCHEMBL29385615 0.80 GPR35 (0.57) GPR35TTRMAPTLMNAMEN1
SCHEMBL4172077 0.80 TTR (0.67) GPR35TTRMAPTLMNAMEN1
Niclofolan SCHEMBL1498232 0.80 GPR35 (0.57) GPR35TTRMAPTLMNAMEN1
SCHEMBL5654609 0.78 GPR35 (0.66) GPR35TTRMAPTLMNAMEN1
SCHEMBL11851949 0.78 MAPT (0.61) GPR35TTRMAPTLMNAMEN1
SCHEMBL18304977 0.77 TTR (0.54) GPR35TTRMAPTLMNAMEN1
SCHEMBL1248770 0.77 GPR35 (0.65) GPR35TTRMAPTLMNAMEN1

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-105209444-A Benzo-fused heterocyclic derivatives useful as agonists of GPR120 JANSSEN PHARMACEUTICA NV 2015-12-30 CN disclosed