SCHEMBL1744651

SCHEMBL1744651

Cc1cc2ccn(CCO[Si](C)(C)C(C)(C)C)c2cc1N

nearest known ligand 0.41

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
DUT P33316 2/20 0.41
DGAT1 O75907 3/20 0.34
MCL1 Q07820 5/20 0.33
HTR2A P28223 3/20 0.32
HTR2C P28335 3/20 0.32
ATAD2 Q6PL18 1/20 0.31
HTR7 P34969 2/20 0.31
TERT O14746 1/20 0.30

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
SCHEMBL1744945 0.89 DUT (0.36) DUTDGAT1HTR7
SCHEMBL3997142 0.82 PRKCI (0.45) DUTDGAT1HTR2AHTR2CHTR7
SCHEMBL4001230 0.82 DUT (0.45) DUTDGAT1MCL1HTR2AHTR2C
SCHEMBL9091990 0.81 HTR2A (0.48) DUTHTR2AHTR2CHTR7
SCHEMBL1744241 0.80 DUT (0.40) DUTDGAT1MCL1HTR7
SCHEMBL9092781 0.80 HTR7 (0.49) DUTMCL1HTR2AHTR2CHTR7
SCHEMBL25374134 0.78 DUT (0.41) DUTDGAT1MCL1HTR2AHTR2C
SCHEMBL1746766 0.78 HTR2A (0.32) DUTHTR2AHTR2CATAD2TERT
SCHEMBL1463344 0.78 HTR2A (0.32) DUTHTR2AHTR2CATAD2TERT
SCHEMBL31609651 0.78 DUT (0.41) DUTDGAT1MCL1HTR2AHTR2C

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8372865-B2 Dihydropyridone amides as P2X7 modulators ROCHE PALO ALTO LLC (US) 2013-02-12 US disclosed
US-8372865-B2 Dihydropyridone amides as P2X7 modulators ROCHE PALO ALTO LLC (US) 2013-02-12 US disclosed
US-8372865-B2 Dihydropyridone amides as P2X7 modulators ROCHE PALO ALTO LLC (US) 2013-02-12 US disclosed
EP-2385939-A1 DIHYDROPYRIDONE AMIDES AS P2X7 MODULATORS F. Hoffmann-La Roche AG (CH) 2011-11-16 EP disclosed
US-8041551-B1 Algorithm and architecture for multi-argument associative operations that minimizes the number of components using a latency of the components THE MATHWORKS, INC. (US) 2011-10-18 US disclosed
WO-2010072597-A1 DIHYDROPYRIDONE AMIDES AS P2X7 MODULATORS F. HOFFMANN-LA ROCHE AG (CH) 2010-07-01 WO disclosed
US-20100160373-A1 DIHYDROPYRIDONE AMIDES AS P2X7 MODULATORS ROCHE PALO ALTO LLC 2010-06-24 US disclosed
US-20100160373-A1 DIHYDROPYRIDONE AMIDES AS P2X7 MODULATORS ROCHE PALO ALTO LLC 2010-06-24 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-20100160373-A1 DIHYDROPYRIDONE AMIDES AS P2X7 MODULATORS P2RY1, P2RX3, P2RX1 DUT 1451/4885DGAT1 4339/4885MCL1 2482/4885

“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.