SCHEMBL6664567

SCHEMBL6664567

O=C(Nc1ccc2c(c1)CCN2)c1cc([N+](=O)[O-])ccc1-c1ccccc1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 5/20 0.47
MAPT P10636 5/20 0.47
MEN1 O00255 4/20 0.47
SMN1; SMN2 Q16637 4/20 0.47
PPARG P37231 2/20 0.47
LMNA P02545 1/20 0.47
TP53 P04637 1/20 0.47
CYP1A2 P05177 1/20 0.47
CYP3A4 P08684 1/20 0.47
CYP2D6 P10635 1/20 0.47
CYP2C9 P11712 1/20 0.47
PKM P14618 1/20 0.47
TSHR P16473 1/20 0.47
NFKB1 P19838 1/20 0.47
MAPK1 P28482 1/20 0.47
CYP2C19 P33261 1/20 0.47
THPO P40225 1/20 0.47
MTOR P42345 1/20 0.47
RORC P51449 1/20 0.47
PMP22 Q01453 1/20 0.47

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
SCHEMBL6808697 0.89 MAPT (0.49) KMT2AMAPTMEN1SMN1; SMN2LMNA
SCHEMBL6662272 0.83 L3MBTL1 (0.51) KMT2AMEN1LMNATP53CYP3A4
Hydrochloric Acid SCHEMBL6664266 0.82 L3MBTL1 (0.50) KMT2AMEN1LMNATP53CYP3A4
SCHEMBL6663197 0.82 USP28 (0.46) LMNATP53CFTRL3MBTL1
SCHEMBL6665172 0.81 GAA (0.54) KMT2AMAPTMEN1SMN1; SMN2CYP1A2
SCHEMBL6665641 0.81 APOB (0.51) TP53RXFP1
Hydrochloric Acid SCHEMBL6662670 0.80 APOB (0.50) TP53RXFP1
SCHEMBL6804465 0.76 L3MBTL1 (0.52) KMT2AMEN1LMNATP53CYP2C9
SCHEMBL6662843 0.76 SLC2A1 (0.49) KMT2AMEN1LMNATP53CYP2C9
Hydrochloric Acid SCHEMBL6803617 0.75 L3MBTL1 (0.51) KMT2AMEN1LMNATP53CYP2C9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1383760-A1 BIARYLCARBOXAMIDE COMPOUNDS AS APOLIPOPROTEIN B INHIBITORS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2004-01-28 EP disclosed
WO-2002090347-A1 AMIDE COMPOUNDS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2002-11-14 WO disclosed