SCHEMBL22624798

SCHEMBL22624798

N#Cc1ccccc1/N=C/c1cc([N+](=O)[O-])ccc1O

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 10/20 0.59
▸ FNTA P49354 1/20 0.55
▸ FNTB P49356 1/20 0.55
▸ PKM P14618 1/20 0.53
▸ MEN1 O00255 8/20 0.52
▸ KMT2A Q03164 8/20 0.52
▸ HTT P42858 5/20 0.52
▸ SMN1; SMN2 Q16637 5/20 0.52
▸ NPC1 O15118 4/20 0.52
▸ LMNA P02545 4/20 0.52
▸ TDP1 Q9NUW8 3/20 0.52
▸ RECQL P46063 2/20 0.52
▸ POLB P06746 2/20 0.52
▸ MAPK1 P28482 1/20 0.52
▸ ALDH1A1 P00352 3/20 0.51
▸ HCRTR1 O43613 1/20 0.51
▸ RAB9A P51151 3/20 0.50
▸ GAA P10253 3/20 0.50
▸ MAOB P27338 1/20 0.50
▸ KDM4E B2RXH2 3/20 0.49

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
SCHEMBL14159177 0.88 MAPT (0.56) MAPTFNTAFNTBPKMMEN1
SCHEMBL12443189 0.84 MAPT (0.63) MAPTFNTAFNTBPKMMEN1
SCHEMBL22624834 0.81 MAPT (0.70) MAPTFNTAFNTBPKMMEN1
SCHEMBL22624755 0.81 MAPT (0.60) MAPTFNTAFNTBPKMMEN1
SCHEMBL14237845 0.81 MAPT (0.60) MAPTFNTAFNTBPKMMEN1
SCHEMBL10182503 0.81 MAPT (0.65) MAPTFNTAFNTBPKMMEN1
SCHEMBL17395842 0.81 MAPT (0.65) MAPTFNTAFNTBPKMMEN1
SCHEMBL17395868 0.81 MAPT (0.65) MAPTFNTAFNTBPKMMEN1
SCHEMBL17395843 0.81 MAPT (0.65) MAPTFNTAFNTBPKMMEN1
SCHEMBL22624707 0.80 ERN1 (0.54) MAPTFNTAFNTBMEN1KMT2A

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-20210317076-A9 COMPOUNDS WITH ANTIMICROBIAL ACTIVITY THE HONG KONG POLYTECHNIC UNIVERSITY (CN) 2021-10-14 — — US disclosed
US-20200347010-A1 COMPOUNDS WITH ANTIMICROBIAL ACTIVITY UNIV HONG KONG POLYTECHNIC (CN) 2020-11-05 — — US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20200347010-A1 COMPOUNDS WITH ANTIMICROBIAL ACTIVITY CFTR, FPR3, FPR1 MAPT 4046/4885FNTA 3978/4885FNTB 3723/4885
US-20210317076-A9 COMPOUNDS WITH ANTIMICROBIAL ACTIVITY CFTR, FPR3, FPR1 MAPT 4046/4885FNTA 3978/4885FNTB 3723/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

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