SCHEMBL6975308

SCHEMBL6975308

O=C(O)Nc1ccc(O)c([N+](=O)[O-])c1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.54
MAPK1 P28482 4/20 0.54
SMN1; SMN2 Q16637 4/20 0.54
LMNA P02545 4/20 0.54
MEN1 O00255 4/20 0.54
KMT2A Q03164 4/20 0.54
NPC1 O15118 2/20 0.54
RAB9A P51151 1/20 0.54
ALDH1A1 P00352 2/20 0.53
TP53 P04637 1/20 0.53
HPGD P15428 1/20 0.53
TSHR P16473 1/20 0.53
GPR35 Q9HC97 1/20 0.53
ALDH5A1 P51649 1/20 0.53
ABAT P80404 1/20 0.53
EGFR P00533 1/20 0.52
L3MBTL1 Q9Y468 2/20 0.51
ALOX15 P16050 1/20 0.51
HSD17B10 Q99714 1/20 0.51
P2RX1 P51575 1/20 0.51

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
SCHEMBL6975312 1.00 MAPT (0.54) MAPTMAPK1SMN1; SMN2LMNAMEN1
SCHEMBL16702025 0.87 ABCC1 (0.51) MAPTMAPK1SMN1; SMN2LMNAMEN1
SCHEMBL16702023 0.87 ABCC1 (0.51) MAPTMAPK1SMN1; SMN2LMNAMEN1
SCHEMBL27761089 0.85 MAPK1 (0.54) MAPTMAPK1SMN1; SMN2LMNAMEN1
SCHEMBL3801985 0.85 HTT (0.68) MAPTMAPK1SMN1; SMN2LMNAMEN1
SCHEMBL4341820 0.84 MAPT (0.72) MAPTMAPK1SMN1; SMN2LMNAMEN1
SCHEMBL11194941 0.83 AURKB (0.62) MAPTMAPK1SMN1; SMN2LMNAMEN1
SCHEMBL2312502 0.83 KMT2A (0.75) MAPTMAPK1SMN1; SMN2LMNAMEN1
SCHEMBL2312499 0.83 KMT2A (0.75) MAPTMAPK1SMN1; SMN2LMNAMEN1
SCHEMBL7213151 0.82 ALDH1A1 (0.56) MAPTMAPK1SMN1; SMN2LMNAMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4305040-A1 TRICYCLIC PYRIDINES AS CYCLIN-DEPENDENT KINASE 7 (CDK7) INHIBITORS JANSSEN Pharmaceutica NV (BE) 2024-01-17 EP disclosed
EP-1106608-B1 Substituted (dihydro)benzoxazine and (dihydro)benzothiazine derivatives, process for their preparation and pharmaceutical compositions containing them SERVIER LAB (FR) 2003-03-05 EP disclosed
EP-1106608-A1 Substituted (dihydro)benzoxazine and (dihydro)benzothiazine derivatives, process for their preparation and pharmaceutical compositions containing them ADIR ET COMPAGNIE (FR) 2001-06-13 EP disclosed