SCHEMBL31403667

SCHEMBL31403667

Cc1c([N+](=O)[O-])cnc2[nH]cc(Cl)c12

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PIN1 Q13526 2/20 0.37
KDM4E B2RXH2 1/20 0.35
PKM P14618 2/20 0.35
SMN1; SMN2 Q16637 1/20 0.34
TDP1 Q9NUW8 3/20 0.33
ALDH1A1 P00352 2/20 0.33
MAPT P10636 2/20 0.33
NOTUM Q6P988 1/20 0.33
DAO P14920 1/20 0.33
CYP1A2 P05177 1/20 0.33
CYP2C9 P11712 1/20 0.33
CYP2C19 P33261 1/20 0.33
LMNA P02545 2/20 0.33
HTT P42858 2/20 0.33
MAPK1 P28482 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.32
GSK3B P49841 1/20 0.32
PGK1 P00558 1/20 0.32
KLKB1 P03952 1/20 0.32
MAP4K1 Q92918 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
SCHEMBL31403638 0.83 KDM4E (0.36) PIN1KDM4ESMN1; SMN2TDP1ALDH1A1
SCHEMBL17920787 0.73 CYP1A2 (0.36) KDM4ESMN1; SMN2TDP1ALDH1A1MAPT
SCHEMBL1467726 0.73 ALDH1A1 (0.33) PIN1KDM4ESMN1; SMN2TDP1ALDH1A1
SCHEMBL1565894 0.72 NOTUM (0.37) NOTUMDAOMAPK1KLKB1MAP4K1
SCHEMBL15349776 0.70 MAPT (0.35) PIN1SMN1; SMN2TDP1ALDH1A1MAPT
SCHEMBL15155185 0.70 KDM4E (0.35) KDM4ESMN1; SMN2TDP1ALDH1A1MAPT
SCHEMBL9149365 0.70 TDP1 (0.42) PIN1SMN1; SMN2TDP1ALDH1A1MAPT
SCHEMBL30213789 0.69 PRKCI (0.46) SMN1; SMN2TDP1ALDH1A1MAPTMAPK1
SCHEMBL858934 0.69 LRRK2 (0.50) KDM4EPKMSMN1; SMN2TDP1ALDH1A1
SCHEMBL17495401 0.69 PRKCI (0.46) SMN1; SMN2TDP1ALDH1A1MAPTMAPK1

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-2025076284-A1 COMPOUNDS, PHARMACEUTICAL COMPOSITIONS THEREOF, AND METHODS OF USING THE SAME DELPHIA THERAPEUTICS, INC. (US) 2025-04-10 WO disclosed