SCHEMBL9740010

SCHEMBL9740010

CC(CO)Nc1nc(Oc2ccc(C(F)(F)F)cc2Cl)ccc1[N+](=O)[O-]

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.48
KMT2A Q03164 2/20 0.48
TTR P02766 1/20 0.48
PPOX P50336 1/20 0.48
TDP1 Q9NUW8 1/20 0.48
FGFR4 P22455 1/20 0.43
MAOA P21397 1/20 0.41
MAPT P10636 5/20 0.40
HTT P42858 2/20 0.40
PKM P14618 1/20 0.39
POLB P06746 2/20 0.39
LMNA P02545 1/20 0.39
CCR6 P51684 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
GPR55 Q9Y2T6 1/20 0.39
ALDH1A1 P00352 2/20 0.38
FFAR1 O14842 1/20 0.38
HPGD P15428 1/20 0.38
NPC1 O15118 1/20 0.38
CYP1A2 P05177 1/20 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
SCHEMBL11017176 0.81 MEN1 (0.60) MEN1KMT2ATTRPPOXTDP1
SCHEMBL8509302 0.80 TDP1 (0.59) MEN1KMT2ATTRPPOXTDP1
SCHEMBL10980211 0.80 KMT2A (0.59) MEN1KMT2ATTRPPOXTDP1
SCHEMBL10984849 0.79 KMT2A (0.57) MEN1KMT2ATTRPPOXTDP1
SCHEMBL10990765 0.77 TDP1 (0.55) MEN1KMT2ATTRPPOXTDP1
SCHEMBL11007482 0.76 MEN1 (0.48) MEN1KMT2ATTRPPOXTDP1
SCHEMBL9017263 0.75 KMT2A (0.53) MEN1KMT2ATTRPPOXTDP1
SCHEMBL9854877 0.74 TDP1 (0.55) MEN1KMT2ATTRPPOXTDP1
SCHEMBL11347907 0.73 MEN1 (0.62) MEN1KMT2ATTRPPOXTDP1
SCHEMBL10454658 0.72 MEN1 (0.62) MEN1KMT2ATTRPPOXTDP1

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
US-5133798-A Certain herbicidal 1,2,4-triazolo[4,5-b]pyridines IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1992-07-28 US disclosed
EP-0453065-A1 Triazolopyridine derivatives ZENECA LIMITED (GB) 1991-10-23 EP disclosed