SCHEMBL15218846

SCHEMBL15218846

CCOC(=O)C1(NC)COCCOC1

nearest known ligand 0.41

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.41
ATM Q13315 1/20 0.38
ALDH1A1 P00352 4/20 0.35
GAA P10253 2/20 0.34
MGAM O43451 1/20 0.34
SI P14410 1/20 0.34
MGAM2 Q2M2H8 1/20 0.34
RECQL P46063 1/20 0.34
RAB9A P51151 3/20 0.33
POLB P06746 2/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
LMNA P02545 3/20 0.33
MAPT P10636 2/20 0.33
ABCB11 O95342 1/20 0.33
MAPK1 P28482 1/20 0.33
HPGD P15428 1/20 0.33
KMT2A Q03164 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
SMN1; SMN2 Q16637 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
SCHEMBL2787784 0.79 MGAM (0.41) ATMALDH1A1GAAMGAMSI
Hydrochloric Acid SCHEMBL2787783 0.77 MGAM (0.39) ATMALDH1A1GAAMGAMSI
SCHEMBL27570845 0.76 SMN1; SMN2 (0.38) ATMALDH1A1GAAMGAMSI
SCHEMBL12683544 0.76 SMN1; SMN2 (0.41) ATMALDH1A1GAAMGAMSI
SCHEMBL15218845 0.74 KDM4E (0.33) KMT2A
SCHEMBL15461458 0.74 ALDH1A1 (0.38) TSHRATMALDH1A1GAAMGAM
SCHEMBL21491715 0.72 NPSR1 (0.33) ALDH1A1L3MBTL1MAPTKMT2ANPSR1
SCHEMBL9515002 0.72 TSHR (0.48) TSHRATMALDH1A1GAARECQL
SCHEMBL9515523 0.72 TSHR (0.48) TSHRATMALDH1A1GAARECQL
SCHEMBL11242645 0.70 ATM (0.40) TSHRATMALDH1A1GAARECQL

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8865716-B2 Dihydropteridinones II BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2014-10-21 US disclosed
US-8865716-B2 Dihydropteridinones II BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2014-10-21 US disclosed
WO-2014127816-A1 DIHYDROPTERIDINONES II BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2014-08-28 WO disclosed
US-20130225593-A1 DIHYDROPTERIDINONES II BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2013-08-29 US disclosed
US-20130225593-A1 DIHYDROPTERIDINONES II BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2013-08-29 US 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-20130225593-A1 DIHYDROPTERIDINONES II BACE1, BACE2, APP TSHR 4731/4885ATM 4423/4885ALDH1A1 3315/4885

“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.