SCHEMBL30952004

SCHEMBL30952004

N=C(N)COC(=O)Cc1ccccc1

nearest known ligand 0.68

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PAM P19021 1/20 0.68
L3MBTL1 Q9Y468 3/20 0.59
ALDH1A1 P00352 2/20 0.59
MAPK1 P28482 2/20 0.59
KMT2A Q03164 2/20 0.54
TSHR P16473 1/20 0.47
MEN1 O00255 1/20 0.47
CES2 O00748 1/20 0.45
CES1 P23141 1/20 0.45
AKR1B1 P15121 1/20 0.45
MAPT P10636 1/20 0.45
CASP1 P29466 1/20 0.45
KLK7 P49862 1/20 0.44
MGLL Q99685 2/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
HTT P42858 1/20 0.44
TDP1 Q9NUW8 1/20 0.44

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
SCHEMBL4947139 0.85 PAM (0.72) PAML3MBTL1ALDH1A1MAPK1KMT2A
SCHEMBL4947133 0.81 PAM (0.72) PAML3MBTL1ALDH1A1MAPK1KMT2A
SCHEMBL5999038 0.81 PAM (0.78) PAML3MBTL1ALDH1A1MAPK1KMT2A
SCHEMBL3748732 0.81 PAM (1.00) PAML3MBTL1ALDH1A1MAPK1KMT2A
SCHEMBL24487079 0.78 L3MBTL1 (0.54) PAML3MBTL1ALDH1A1MAPK1KMT2A
SCHEMBL3673828 0.78 PAM (0.72) PAML3MBTL1ALDH1A1MAPK1KMT2A
SCHEMBL1449153 0.77 ALDH1A1 (0.68) PAML3MBTL1ALDH1A1MAPK1KMT2A
Bicarbonate SCHEMBL6989215 0.77 CES1 (0.56) L3MBTL1ALDH1A1MAPK1KMT2AMEN1
SCHEMBL1434644 0.77 ALDH1A1 (0.73) PAML3MBTL1ALDH1A1MAPK1KMT2A
SCHEMBL6988546 0.76 PAM (0.70) PAML3MBTL1ALDH1A1MAPK1KMT2A

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-11981645-B1 N′-(2-naphthoyloxy)-2-(benzo[d]oxazol-2-yl)acetimidamide as antimicrobial compound King Faisal University (SA) 2024-05-14 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-11981645-B1 N′-(2-naphthoyloxy)-2-(benzo[d]oxazol-2-yl)acetimidamide as antimicrobial compound NOC2L, NIT2, NAALAD2 PAM 34/4885L3MBTL1 2583/4885ALDH1A1 1519/4885

“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.