SCHEMBL7471024

SCHEMBL7471024

C[SiH](C)OC(CC(C)(C)C)C1Oc2cc([N+](=O)[O-])ccc2NC1=O

nearest known ligand 0.45

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 8/20 0.45
MEN1 O00255 6/20 0.45
ALDH1A1 P00352 5/20 0.45
GAA P10253 1/20 0.43
MAPT P10636 6/20 0.42
MAPK1 P28482 1/20 0.42
POLB P06746 2/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
PGR P06401 1/20 0.34
CYP1A2 P05177 1/20 0.33
CYP3A4 P08684 1/20 0.33
ALOX15 P16050 1/20 0.33
HSD17B10 Q99714 1/20 0.33
BRD4 O60885 1/20 0.33
CAPN9 O14815 1/20 0.33
CASP3 P42574 1/20 0.33
SNCA P37840 1/20 0.31

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
SCHEMBL7472179 0.93 KMT2A (0.38) KMT2AMEN1ALDH1A1GAAMAPT
SCHEMBL7468810 0.85 BRD4 (0.38) KMT2AMEN1GAAMAPTALOX15
SCHEMBL7468474 0.84 BRD4 (0.35) BRD4
SCHEMBL7478462 0.83 KMT2A (0.36) KMT2AMEN1ALDH1A1MAPTMAPK1
SCHEMBL7472405 0.82 PARP1 (0.45) KMT2AMEN1ALDH1A1GAAMAPT
SCHEMBL7470575 0.79 USP2 (0.45) KMT2AMEN1ALDH1A1GAAMAPT
SCHEMBL7472656 0.78 USP2 (0.33) GAAMAPK1L3MBTL1HSD17B10
SCHEMBL7463447 0.78 HSD17B10 (0.41) ALDH1A1GAAMAPK1POLBHSD17B10
SCHEMBL7471041 0.78 KMT2A (0.52) KMT2AMEN1ALDH1A1GAAMAPT
SCHEMBL7475251 0.77 HSD17B10 (0.40) KMT2AMEN1ALDH1A1GAAMAPT

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-0869949-B1 BENZOXAZINE ANTIMICROBIAL AGENTS ORTHO MCNEIL PHARM INC (US) 2002-12-18 EP disclosed
US-5854242-A Benzoxazine antimicrobial agents ORTHO PHARMACEUTICAL CORPORATION (US) 1998-12-29 US disclosed
US-5696117-A BACTERICIDE ORTHO PHARMACEUTICAL CORPORATION (US) 1997-12-09 US disclosed