SCHEMBL10168063

SCHEMBL10168063

CCOC(OCC)C(=O)Cc1nccn1C(c1ccccc1)(c1ccccc1)c1ccccc1

nearest known ligand 0.39

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 5/20 0.39
MEN1 O00255 3/20 0.39
CYP2D6 P10635 2/20 0.32
BLM P54132 1/20 0.32
EDNRB P24530 1/20 0.32
EDNRA P25101 1/20 0.32
FDPS P14324 1/20 0.32
PPARG P37231 3/20 0.31
PPARA Q07869 2/20 0.31
CYP1A2 P05177 2/20 0.31
CYP3A4 P08684 1/20 0.31
GAA P10253 1/20 0.31
CYP2C9 P11712 1/20 0.31
CYP2C19 P33261 1/20 0.31
MAPK1 P28482 1/20 0.31
ALDH1A1 P00352 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
SCHEMBL8170659 0.82 TBXAS1 (0.41) KMT2AMEN1GAAALDH1A1
SCHEMBL6446028 0.80 KMT2A (0.43) KMT2AMEN1CYP2D6BLMFDPS
SCHEMBL5325316 0.76 SMN1; SMN2 (0.43) KMT2AMEN1ALDH1A1
SCHEMBL8188378 0.75 KMT2A (0.46) KMT2AMEN1CYP2D6CYP1A2CYP3A4
SCHEMBL6027451 0.74 FDPS (0.41) KMT2AMEN1FDPSALDH1A1
SCHEMBL2852162 0.74 KMT2A (0.40) KMT2AMEN1CYP2D6BLMFDPS
SCHEMBL8806580 0.73 KMT2A (0.44) KMT2AMEN1ALDH1A1
SCHEMBL7971128 0.72 ALDH1A1 (0.43) KMT2AMEN1CYP2D6BLMALDH1A1
SCHEMBL647893 0.72 KMT2A (0.46) KMT2AMEN1CYP2D6BLMFDPS
SCHEMBL5319750 0.72 MEN1 (0.41) KMT2AMEN1CYP2D6BLMFDPS

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9840730-B2 Oplophorus-derived luciferases, novel coelenterazine substrates, and methods of use PROMEGA CORPORATION (US) 2017-12-12 US disclosed
EP-2635582-B1 NOVEL COELENTERAZINE SUBSTRATES AND METHODS OF USE PROMEGA CORP (US) 2016-01-27 EP disclosed
US-20160002703-A1 IMIDAZO[1,2-alpha]PYRAZINE DERIVATIVES JPMORGAN CHASE BANK, N.A., AS COLLATERAL AGENT 2016-01-07 US disclosed
US-9139836-B2 Imidazo[1,2-a]pyrazine derivatives PROMEGA CORPORATION (US) 2015-09-22 US disclosed
US-20150064731-A1 OPLOPHORUS-DERIVED LUCIFERASES, NOVEL COELENTERAZINE SUBSTRATES, AND METHODS OF USE JPMORGAN CHASE BANK, N.A., AS COLLATERAL AGENT 2015-03-05 US disclosed
US-8809529-B2 Imidazo[1,2-α]pyrazine derivatives PROMEGA CORPORATION (US) 2014-08-19 US disclosed
US-20140227759-A1 OPLOPHORUS-DERIVED LUCIFERASES, NOVEL COELENTERAZINE SUBSTRATES, AND METHODS OF USE PROMEGA CORPORATION (US) 2014-08-14 US disclosed
US-20140223590-A1 OPLOPHORUS-DERIVED LUCIFERASES, NOVEL COELENTERAZINE SUBSTRATES, AND METHODS OF USE Promego Corporation (US) 2014-08-07 US disclosed
US-8669103-B2 Oplophorus-derived luciferases, novel coelenterazine substrates, and methods of use PROMEGA CORPORATION (US) 2014-03-11 US disclosed
WO-2012061530-A2 OPLOPHORUS-DERIVED LUCIFERASES, NOVEL COELENTERAZINE SUBSTRATES, AND METHODS OF USE PROMEGA CORPORATION (US) 2012-05-10 WO disclosed
WO-2012061529-A1 NOVEL COELENTERAZINE SUBSTRATES AND METHODS OF USE PROMEGA CORPORATION (US) 2012-05-10 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 (2 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-20160002703-A1 IMIDAZO[1,2-alpha]PYRAZINE DERIVATIVES GLB1, NISCH, BOLA2; BOLA2B KMT2A 3183/4885MEN1 1366/4885CYP2D6 802/4885
US-20150064731-A1 OPLOPHORUS-DERIVED LUCIFERASES, NOVEL COELENTERAZINE SUBSTRATES, AND METHODS OF USE GLB1, LUC7L2, GUSB KMT2A 2786/4885MEN1 2343/4885CYP2D6 572/4885

“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.