SCHEMBL28700417

SCHEMBL28700417

O=C(N[N+](=O)[O-])n1ccnc1

nearest known ligand 0.47

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.35
CYP19A1 P11511 4/20 0.35
ALDH1A1 P00352 1/20 0.32
EGLN3 Q9H6Z9 1/20 0.31
FAAH O00519 1/20 0.31
MGLL Q99685 1/20 0.31
KMT2A Q03164 1/20 0.30

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
SCHEMBL22265331 0.80 MAPK1 (0.35) MAPTCYP19A1ALDH1A1
SCHEMBL28901779 0.75 MAPT (0.38) MAPTCYP19A1ALDH1A1EGLN3FAAH
SCHEMBL5202776 0.74
SCHEMBL13589000 0.72
SCHEMBL22019922 0.72
SCHEMBL972555 0.72
SCHEMBL11398624 0.72 MAPT (0.37) MAPTCYP19A1ALDH1A1EGLN3FAAH
SCHEMBL13262611 0.72
SCHEMBL9285625 0.72
Hydrochloric Acid SCHEMBL5149348 0.71 MAPT (0.36) MAPTALDH1A1EGLN3FAAHMGLL

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
CN-113993997-A Modified cleaving enzymes, uses thereof and related kits ENCODIA 公司 2022-01-28 CN disclosed