SCHEMBL7472191

SCHEMBL7472191

CC(O[Si](C)(C)C(C)(C)C)C1Oc2ccc([N+](=O)[O-])cc2NC1=O

nearest known ligand 0.38

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 7/20 0.38
ALDH1A1 P00352 5/20 0.38
MEN1 O00255 5/20 0.38
GAA P10253 1/20 0.36
BRD4 O60885 2/20 0.36
CYP1A2 P05177 2/20 0.35
CYP3A4 P08684 1/20 0.35
ALOX15 P16050 1/20 0.35
HSD17B10 Q99714 1/20 0.35
MAPT P10636 6/20 0.35
MAPK1 P28482 1/20 0.35
POLB P06746 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
CHRNB4 P30926 4/20 0.33
CHRNA3 P32297 4/20 0.33
PGR P06401 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
LMNA P02545 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
SCHEMBL7471034 0.92 KMT2A (0.45) KMT2AALDH1A1MEN1GAABRD4
SCHEMBL4968968 0.82 BRD4 (0.48) KMT2AALDH1A1MEN1GAABRD4
SCHEMBL7463464 0.82 HSD17B10 (0.44) ALDH1A1GAABRD4HSD17B10MAPK1
SCHEMBL8601455 0.82 BRD4 (0.35) GAABRD4HSD17B10MAPK1L3MBTL1
SCHEMBL7473275 0.79 KDM4E (0.41) KMT2AALDH1A1MEN1GAABRD4
SCHEMBL7472419 0.79 PARP1 (0.49) KMT2AALDH1A1MEN1GAABRD4
SCHEMBL15324712 0.78 KMT2A (0.47) KMT2AALDH1A1MEN1GAACYP1A2
SCHEMBL190342 0.77 KMT2A (0.51) KMT2AALDH1A1MEN1GAACYP1A2
SCHEMBL7476305 0.77 ALOX5 (0.45) KMT2AALDH1A1MEN1GAAALOX15
SCHEMBL7468490 0.75 BRD4 (0.42) BRD4PGR

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