SCHEMBL8892234

SCHEMBL8892234

Cc1ccc(-c2nn(C)c(OC(F)F)c2Cl)cc1[N+](=O)[O-]

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 10/20 0.38
ALDH1A1 P00352 9/20 0.38
POLB P06746 2/20 0.38
LMNA P02545 2/20 0.38
MEN1 O00255 3/20 0.37
KMT2A Q03164 3/20 0.37
NPC1 O15118 2/20 0.36
GAA P10253 1/20 0.36
TSHR P16473 2/20 0.35
CYP3A4 P08684 1/20 0.35
RECQL P46063 1/20 0.35
SMN1; SMN2 Q16637 2/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
S1PR4 O95977 1/20 0.34
S1PR1 P21453 1/20 0.34
HTT P42858 1/20 0.34
NPSR1 Q6W5P4 1/20 0.33
MPI P34949 1/20 0.33
RAB9A P51151 1/20 0.33
CHEK2 O96017 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
SCHEMBL7711809 0.90 L3MBTL1 (0.41) MAPTALDH1A1POLBLMNAMEN1
SCHEMBL7707619 0.89 CFTR (0.39) MAPTALDH1A1POLBLMNAMEN1
SCHEMBL7707608 0.85 VCAM1 (0.43) MAPTALDH1A1POLBLMNAMEN1
SCHEMBL8471514 0.82 L3MBTL1 (0.41) MAPTALDH1A1LMNAMEN1KMT2A
SCHEMBL8888283 0.80 TSHR (0.36) MAPTALDH1A1LMNAMEN1KMT2A
SCHEMBL7781838 0.80 KCNH2 (0.38)
SCHEMBL7510124 0.79 L3MBTL1 (0.40) MAPTALDH1A1POLBLMNAMEN1
SCHEMBL8888868 0.77 MAPT (0.36) MAPTALDH1A1POLBLMNAKMT2A
SCHEMBL7749240 0.76 ESPL1 (0.30)
SCHEMBL7707669 0.76 KCNH2 (0.34) ALDH1A1LMNAKMT2ASMN1; SMN2L3MBTL1

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
WO-1997012884-A1 HERBICIDAL 6-HETEROCYCLIC INDAZOLE DERIVATIVES FMC CORPORATION (US) 1997-04-10 WO disclosed