SCHEMBL27819982

SCHEMBL27819982

[CH2]c1cc(F)c(Cl)cc1[N+](=O)[O-]

nearest known ligand 0.41

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TSHR P16473 4/20 0.41
TDP1 Q9NUW8 3/20 0.41
MAPK1 P28482 1/20 0.41
ATM Q13315 1/20 0.41
SLC6A4 P31645 1/20 0.41
ALDH1A1 P00352 6/20 0.40
HIF1A Q16665 2/20 0.40
MAPT P10636 1/20 0.39
CYP3A4 P08684 2/20 0.39
HPGD P15428 1/20 0.39
ALOX15 P16050 1/20 0.39
TXNRD1 Q16881 1/20 0.39
TXNRD3 Q86VQ6 1/20 0.39
TXNRD2 Q9NNW7 1/20 0.39
VCAM1 P19320 5/20 0.38
GPR35 Q9HC97 2/20 0.38

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
SCHEMBL10400092 0.84 TSHR (0.47) TSHRTDP1MAPK1ALDH1A1HIF1A
SCHEMBL9694173 0.82 TSHR (0.50) TSHRTDP1MAPK1ATMSLC6A4
SCHEMBL138641 0.82 TDP1 (0.50) TSHRTDP1MAPK1ATMSLC6A4
SCHEMBL30953155 0.82 TDP1 (0.50) TSHRTDP1MAPK1ATMSLC6A4
SCHEMBL24557845 0.78 ALDH1A1 (0.49) TSHRTDP1MAPK1ATMSLC6A4
SCHEMBL7750707 0.78 ALDH1A1 (0.41) TSHRTDP1MAPK1ATMSLC6A4
SCHEMBL27759780 0.78 KDM4A (0.41) TSHRTDP1MAPK1ATMSLC6A4
SCHEMBL30110338 0.78 TSHR (0.50) TSHRTDP1MAPK1ATMSLC6A4
SCHEMBL3543539 0.78 TSHR (0.50) TSHRTDP1MAPK1ATMSLC6A4
SCHEMBL29739925 0.78 TDP1 (0.50) TSHRTDP1MAPK1ATMSLC6A4

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-101932580-A Imidazopyridine kinase inhibitors GLAXOSMITHKLINE LLC 2010-12-29 CN disclosed