SCHEMBL4358020

SCHEMBL4358020

CC(C)(C)OC(=O)NC1CCCCC1CNC(=O)OCc1ccccc1

nearest known ligand 0.50

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.50
KMT2A Q03164 2/20 0.48
MEN1 O00255 1/20 0.48
SYK P43405 1/20 0.47
CASP3 P42574 3/20 0.47
MAPT P10636 1/20 0.47
PDE4B Q07343 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.47
CPB1 P15086 2/20 0.45
EPHX1 P07099 1/20 0.44
CTSL P07711 2/20 0.43
CTSB P07858 1/20 0.43
CTSS P25774 1/20 0.43
CTSK P43235 1/20 0.43
GAA P10253 1/20 0.43

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
SCHEMBL6614417 0.89 KMT2A (0.52) ALDH1A1KMT2AMEN1SYKCASP3
SCHEMBL4033681 0.87 CPB1 (0.54) ALDH1A1KMT2AMEN1SYKCASP3
SCHEMBL12873055 0.86 KMT2A (0.47) ALDH1A1KMT2AMEN1SYKCASP3
SCHEMBL3563686 0.85 KMT2A (0.56) ALDH1A1KMT2ASYKCASP3PDE4B
SCHEMBL3898666 0.85 ALDH1A1 (0.65) ALDH1A1KMT2AMEN1SYKCASP3
SCHEMBL3898660 0.85 ALDH1A1 (0.65) ALDH1A1KMT2AMEN1SYKCASP3
SCHEMBL15584100 0.82 KMT2A (0.51) ALDH1A1KMT2AMEN1SYKMAPT
SCHEMBL30441712 0.82 KMT2A (0.53) ALDH1A1KMT2ASYKCASP3PDE4B
SCHEMBL10137650 0.81 CPB1 (0.56) ALDH1A1KMT2ASYKCASP3PDE4B
SCHEMBL12873056 0.81 CPB1 (0.56) ALDH1A1KMT2ASYKCASP3PDE4B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1611109-A4 NOVEL QUINAZOLINE DERIVATIVES AND METHODS OF TREATMENT RELATED TO THE USE THEREOF TAISHO PHARMACEUTICAL CO LTD (JP) 2009-06-24 EP disclosed
US-20070010671-A1 Novel quinazoline derivatives and methods of treatment related to the use thereof ARENA PHARMACEUTICALS, INC. 2007-01-11 US disclosed
EP-1611109-A1 NOVEL QUINAZOLINE DERIVATIVES AND METHODS OF TREATMENT RELATED TO THE USE THEREOF TAISHO PHARMACEUTICAL CO., LTD (JP) 2006-01-04 EP disclosed
WO-2004087680-A1 NOVEL QUINAZOLINE DERIVATIVES AND METHODS OF TREATMENT RELATED TO THE USE THEREOF TAISHO PHARMACEUTICAL CO., LTD. (JP) 2004-10-14 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-20070010671-A1 Novel quinazoline derivatives and methods of treatment related to the use thereof MCHR1, GPR119, MCHR2 ALDH1A1 2069/4885KMT2A 792/4885MEN1 647/4885

“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.