SCHEMBL31661733

SCHEMBL31661733

O=[N+]([O-])c1ccc2nn(Cc3cccnc3)cc2c1

nearest known ligand 0.55

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 2/20 0.45
PDE5A O76074 2/20 0.44
SMN1; SMN2 Q16637 2/20 0.44
MAPT P10636 2/20 0.44
KDM4E B2RXH2 1/20 0.44
ALDH1A1 P00352 1/20 0.44
GAA P10253 1/20 0.44
PKM P14618 1/20 0.43
CYP19A1 P11511 2/20 0.43
CYP11B1 P15538 2/20 0.43
CYP11B2 P19099 2/20 0.43
KDM4C Q9H3R0 1/20 0.42
NAMPT P43490 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
ATM Q13315 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
SCHEMBL1730308 0.86 DHFR (0.48) RAB9ASMN1; SMN2MAPTCYP19A1MEN1
SCHEMBL31661574 0.85 POLB (0.47) MAPTALDH1A1CYP19A1KDM4CMEN1
SCHEMBL31661519 0.82 MEN1 (0.46) RAB9ASMN1; SMN2MAPTMEN1KMT2A
SCHEMBL1014119 0.81 KMT2A (0.56) MAPTMEN1KMT2A
SCHEMBL31661440 0.79 ALDH1A1 (0.43) SMN1; SMN2MAPTKDM4EALDH1A1PKM
SCHEMBL8626103 0.78 MAPT (0.58) SMN1; SMN2MAPTALDH1A1PKMKDM4C
SCHEMBL31661685 0.77 CFTR (0.47) RAB9ASMN1; SMN2MAPTKDM4EALDH1A1
SCHEMBL3376851 0.77 CFTR (0.47) RAB9ASMN1; SMN2MAPTKDM4EALDH1A1
SCHEMBL8556009 0.77 PKM (0.53) RAB9ASMN1; SMN2MAPTPKMMEN1
SCHEMBL2643717 0.76 PKM (0.65) RAB9ASMN1; SMN2MAPTKDM4EALDH1A1

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
WO-2025151487-A2 SMALL-MOLECULE INHIBITORS OF ADAR1 REGENTS OF THE UNIVERSITY OF MICHIGAN (US) 2025-07-17 WO disclosed