SCHEMBL22765153

SCHEMBL22765153

NCCN/C(N)=N/[N+](=O)[O-]

nearest known ligand 0.36

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
NOS1 P29475 2/20 0.36
MEN1 O00255 1/20 0.36
NOS3 P29474 1/20 0.36
KMT2A Q03164 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
F2 P00734 1/20 0.33
LMNA P02545 1/20 0.33
ALDH1A1 P00352 1/20 0.32
CYP2C9 P11712 1/20 0.32
HPGD P15428 1/20 0.32
ALOX15 P16050 1/20 0.32
CYP2C19 P33261 1/20 0.32
HSD17B10 Q99714 1/20 0.32

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
Trifluoroacetic Acid SCHEMBL22578585 0.87 F2 (0.35) NOS1MEN1NOS3KMT2ATDP1
SCHEMBL14220423 0.82 LMNA (0.39) KMT2AF2LMNA
SCHEMBL28377793 0.82 LMNA (0.39) KMT2AF2LMNA
SCHEMBL22578660 0.80 F2 (0.36) F2LMNA
SCHEMBL17234482 0.79 LMNA (0.38) MEN1KMT2AF2LMNAALDH1A1
SCHEMBL13154173 0.79 GRIN2D (0.52) MEN1KMT2AF2LMNAALDH1A1
SCHEMBL3129345 0.78 NOS1 (0.59) NOS1MEN1NOS3KMT2ATDP1
SCHEMBL13312926 0.77 DDAH1 (0.46) MEN1KMT2AF2LMNAALDH1A1
SCHEMBL14344842 0.77
SCHEMBL21597311 0.77

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11691949-B2 Quinoline sulfonamide compounds and their use as antibacterial agents OTAGO INNOVATION LIMITED (NZ) 2023-07-04 US disclosed
US-11691949-B2 Quinoline sulfonamide compounds and their use as antibacterial agents OTAGO INNOVATION LIMITED (NZ) 2023-07-04 US disclosed
US-20200385354-A1 Quinoline Sulfonamide Compounds and Their Use as Antibacterial Agents OTAGO INNOVATION LIMITED (NZ) 2020-12-10 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-11691949-B2 Quinoline sulfonamide compounds and their use as antibacterial agents NQO2, SDHA, SIRT5 NOS1 1814/4885MEN1 4440/4885NOS3 1883/4885
US-20200385354-A1 Quinoline Sulfonamide Compounds and Their Use as Antibacterial Agents NQO2, SDHA, SIRT5 NOS1 1814/4885MEN1 4440/4885NOS3 1883/4885

“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.