SCHEMBL6984479

SCHEMBL6984479

CCOC(=O)CC(=O)Cc1cccc([N+](=O)[O-])c1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 9/20 0.57
MEN1 O00255 8/20 0.57
HTT P42858 1/20 0.57
GLO1 Q04760 1/20 0.50
PKM P14618 2/20 0.49
NPC1 O15118 1/20 0.49
HSP90AA1 P07900 1/20 0.49
HPGD P15428 1/20 0.49
CCR6 P51684 1/20 0.49
NPSR1 Q6W5P4 1/20 0.49
APOBEC3G Q9HC16 1/20 0.49
MAPT P10636 5/20 0.48
LMNA P02545 4/20 0.48
HIF1A Q16665 3/20 0.48
CYP1A2 P05177 2/20 0.48
CYP3A4 P08684 2/20 0.48
CYP2C9 P11712 2/20 0.48
CYP2C19 P33261 2/20 0.48
MAPK1 P28482 2/20 0.48
POLB P06746 1/20 0.48

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
SCHEMBL2111020 0.89 KMT2A (0.65) KMT2AMEN1HTTGLO1PKM
SCHEMBL29179991 0.87 KMT2A (0.52) KMT2AMEN1HTTGLO1PKM
SCHEMBL27808945 0.85 RAB9A (0.61) KMT2AMEN1HTTGLO1PKM
SCHEMBL3176303 0.83 LMNA (0.63) KMT2AMEN1HTTPKMMAPT
SCHEMBL7179728 0.82 GLO1 (0.56) KMT2AMEN1HTTGLO1PKM
SCHEMBL520733 0.82 MEN1 (0.58) KMT2AMEN1HTTMAPTCYP2C9
SCHEMBL568614 0.82 TSHR (0.56) KMT2AMEN1HPGDMAPTLMNA
SCHEMBL1205584 0.81 KMT2A (0.60) KMT2AMEN1HTTGLO1PKM
SCHEMBL8172847 0.81 RAB9A (0.53) KMT2AMEN1HTTGLO1PKM
SCHEMBL6484929 0.80 KMT2A (0.51) KMT2AMEN1PKMNPC1HPGD

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
US-20030078251-A1 Benzoxazepinones and their use as squalene synthase inhibitors TAKEDA CHEMICAL INDUSTRIES LTD. (JP) 2003-04-24 US disclosed
EP-1292585-A1 BENZOXAZEPINONES AND THEIR USE AS SQUALENE SYNTHASE INHIBITORS Takeda Chemical Industries, Ltd. (JP) 2003-03-19 EP disclosed
WO-2001098282-A1 BENZOXAZEPINONES AND THEIR USE AS SQUALENE SYNTHASE INHIBITORS TAKEDA CHEMICAL INDUSTRIES, LTD (JP) 2001-12-27 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20030078251-A1 Benzoxazepinones and their use as squalene synthase inhibitors SQLE, CYP17A1, ACOX1 KMT2A 2350/4885MEN1 4556/4885HTT 4475/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.