SCHEMBL2922296

SCHEMBL2922296

CC(C)(C)OC(=O)n1nc(CBr)c2ccc([N+](=O)[O-])cc21

nearest known ligand 0.41

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ELANE P08246 8/20 0.41
F2 P00734 5/20 0.41
PLAU P00749 5/20 0.41
CTRB1 P17538 5/20 0.41
ALDH1A1 P00352 2/20 0.41
MAPT P10636 2/20 0.41
LMNA P02545 1/20 0.41
BRD4 O60885 1/20 0.39
KLKB1 P03952 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.36
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
CREBBP Q92793 1/20 0.36
CNR2 P34972 1/20 0.35
ALOX5 P09917 1/20 0.34

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
SCHEMBL2469626 0.91 ELANE (0.44) ELANEF2PLAUCTRB1ALDH1A1
SCHEMBL12999396 0.87 ELANE (0.40) ELANEF2PLAUCTRB1ALDH1A1
SCHEMBL22777374 0.85 MAPT (0.44) ELANEF2PLAUCTRB1ALDH1A1
SCHEMBL1709876 0.84 ELANE (0.47) ELANEF2PLAUCTRB1ALDH1A1
SCHEMBL3964153 0.83 MAPT (0.44) ELANEF2PLAUCTRB1ALDH1A1
SCHEMBL6170318 0.83 MAPT (0.44) ELANEF2PLAUCTRB1ALDH1A1
SCHEMBL27730187 0.83 ELANE (0.43) ELANEF2PLAUCTRB1ALDH1A1
SCHEMBL8426868 0.81 MAP2K4 (0.37) BRD4SMN1; SMN2
SCHEMBL27585778 0.81 ELANE (0.42) ELANEF2PLAUCTRB1ALDH1A1
SCHEMBL10074640 0.81 DYRK1A (0.39) ELANEALDH1A1BRD4MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100311965-A1 2-AMINOQUINAZOLINE DERIVATIVE CARNA BIOSCIENCES INC. (JP) 2010-12-09 US disclosed
US-20100311965-A1 2-AMINOQUINAZOLINE DERIVATIVE CARNA BIOSCIENCES INC. (JP) 2010-12-09 US disclosed
US-20100311965-A1 2-AMINOQUINAZOLINE DERIVATIVE CARNA BIOSCIENCES INC. (JP) 2010-12-09 US disclosed
EP-2226315-A1 2-AMINOQUINAZOLINE DERIVATIVE Carna Biosciences Inc. (JP) 2010-09-08 EP disclosed
EP-2226315-A1 2-AMINOQUINAZOLINE DERIVATIVE Carna Biosciences Inc. (JP) 2010-09-08 EP disclosed
WO-2009084695-A1 2-AMINOQUINAZOLINE DERIVATIVE CARNA BIOSCIENCES INC. (JP) 2009-07-09 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-20100311965-A1 2-AMINOQUINAZOLINE DERIVATIVE DSTYK, ABL1, EEF2K ELANE 4175/4885F2 3621/4885PLAU 3768/4885

“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.