SCHEMBL14733305

SCHEMBL14733305

Cc1nc(N)c(C2=CCN(C)CC2)c(N)n1

nearest known ligand 0.46

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
QDPR P09417 2/20 0.44
HTR6 P50406 1/20 0.41

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
SCHEMBL31536273 0.75 QDPR (0.45) QDPRHTR6
SCHEMBL9836374 0.74 MAPT (0.45) QDPRHTR6
SCHEMBL31718158 0.73 QDPR (0.63) QDPR
SCHEMBL16041291 0.73 QDPR (0.41) QDPRHTR6
SCHEMBL7077303 0.70 QDPR (0.44) QDPRHTR6
SCHEMBL25143571 0.70 SIGMAR1 (0.42) QDPR
SCHEMBL28503673 0.69 HTR6 (0.56) QDPRHTR6
SCHEMBL15769914 0.69 QDPR (0.40) QDPR
SCHEMBL1814323 0.68 QDPR (0.68) QDPR
SCHEMBL29086710 0.68 SLC6A4 (0.46) QDPRHTR6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20130053513-A1 LIQUID CRYSTAL ALIGNMENT AGENT, AND LIQUID CRYSTAL ALIGNMENT FILM AND LIQUID CRYSTAL DISPLAY ELEMENT FORMED FROM THE LIQUID CRYSTAL ALIGNMENT AGENT CHI MEI CORPORATION (TW) 2013-02-28 US disclosed