SCHEMBL28796124

SCHEMBL28796124

N#[N+]Nc1ccc([N+](=O)[O-])cc1F

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 9/20 0.49
▸ ALDH1A1 P00352 8/20 0.49
▸ KMT2A Q03164 8/20 0.49
▸ MEN1 O00255 7/20 0.49
▸ SMN1; SMN2 Q16637 3/20 0.49
▸ NPC1 O15118 2/20 0.49
▸ RAB9A P51151 2/20 0.49
▸ HIF1A Q16665 1/20 0.47
▸ HTT P42858 5/20 0.45
▸ LMNA P02545 5/20 0.45
▸ NPSR1 Q6W5P4 1/20 0.45
▸ MAPK1 P28482 1/20 0.42
▸ GAA P10253 1/20 0.39
▸ THRB P10828 1/20 0.39
▸ L3MBTL1 Q9Y468 1/20 0.39
▸ POLB P06746 1/20 0.39
▸ GFER P55789 1/20 0.39
▸ TSHR P16473 2/20 0.38
▸ RORC P51449 1/20 0.38
▸ HSD17B10 Q99714 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
SCHEMBL27452979 0.81 MAPT (0.53) MAPTALDH1A1KMT2AMEN1SMN1; SMN2
SCHEMBL28729800 0.80 ALDH1A1 (0.55) MAPTALDH1A1KMT2AMEN1SMN1; SMN2
SCHEMBL28785612 0.80 POLB (0.50) MAPTALDH1A1KMT2AMEN1SMN1; SMN2
SCHEMBL28456007 0.80 HSD17B10 (0.55) MAPTALDH1A1KMT2AMEN1SMN1; SMN2
SCHEMBL31114316 0.77 MAPT (0.52) MAPTALDH1A1KMT2AMEN1SMN1; SMN2
SCHEMBL3755633 0.77 MAPT (0.52) MAPTALDH1A1KMT2AMEN1SMN1; SMN2
SCHEMBL5001388 0.77 MAPT (0.58) MAPTALDH1A1KMT2AMEN1SMN1; SMN2
SCHEMBL29244800 0.77 ALDH1A1 (0.55) MAPTALDH1A1KMT2AMEN1SMN1; SMN2
SCHEMBL18840091 0.76 HTT (0.61) MAPTALDH1A1KMT2ASMN1; SMN2HTT
Hydrochloric Acid SCHEMBL1117932 0.76 MAPT (0.51) MAPTALDH1A1KMT2AMEN1SMN1; SMN2

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
CN-114836997-B In-situ coupling color development method of meta-aramid fiber and obtained color development aramid fiber 浙江理工大学 2023-10-31 — — CN disclosed
CN-114836997-A In-situ coupling color development method of meta-aramid and obtained color development aramid 浙江理工大学 2022-08-02 — — CN disclosed
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