SCHEMBL6415841

SCHEMBL6415841

Cc1csc(-c2ccc(F)cc2[N+](=O)[O-])n1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EIF4E P06730 6/20 0.43
TDP1 Q9NUW8 2/20 0.42
ATM Q13315 1/20 0.42
SMN1; SMN2 Q16637 4/20 0.42
MEN1 O00255 3/20 0.42
KMT2A Q03164 3/20 0.42
MAPT P10636 3/20 0.42
TP53 P04637 1/20 0.42
GABRA1 P14867 1/20 0.41
GABRG2 P18507 1/20 0.41
GABRB3 P28472 1/20 0.41
GABRA5 P31644 1/20 0.41
GABRA3 P34903 1/20 0.41
GABRA2 P47869 1/20 0.41
ALDH1A1 P00352 3/20 0.41
NPC1 O15118 2/20 0.41
RAB9A P51151 2/20 0.41
LMNA P02545 2/20 0.41
HPGD P15428 2/20 0.41
NFKB1 P19838 1/20 0.41

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
SCHEMBL995671 0.85 TSHR (0.50) EIF4ETDP1SMN1; SMN2MEN1KMT2A
SCHEMBL996621 0.82 GAA (0.49) EIF4ETDP1MEN1KMT2AMAPT
SCHEMBL829974 0.79 MGAM (0.51) EIF4ETDP1SMN1; SMN2MEN1KMT2A
SCHEMBL9910051 0.77 GABRA1 (0.44) EIF4ESMN1; SMN2MEN1KMT2AMAPT
SCHEMBL29462665 0.76 ATM (0.63) TDP1ATMMAPTALDH1A1MAPK1
SCHEMBL6206158 0.75 GABRA1 (0.43) SMN1; SMN2MEN1KMT2AMAPTTP53
SCHEMBL23367951 0.74 PYGL (0.46) EIF4ETDP1SMN1; SMN2GABRA1GABRG2
SCHEMBL3711601 0.72 ALDH1A1 (0.41) TDP1SMN1; SMN2MEN1KMT2AMAPT
SCHEMBL968154 0.71 MGAM (0.43) EIF4ETDP1ATMMEN1KMT2A
SCHEMBL13806246 0.71 APP (0.52) TDP1SMN1; SMN2MEN1KMT2AMAPT

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
US-20050277676-A1 M3muscarinic acetylcholine receptor antagonists GLAXO GROUP LIMITED (GB) 2005-12-15 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 (1 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-20050277676-A1 M3muscarinic acetylcholine receptor antagonists CHRM3, CHRM2, CHRM5 EIF4E 4881/4885TDP1 3534/4885ATM 4079/4885

“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.