SCHEMBL6068441

SCHEMBL6068441

Cc1cc(-c2nnn3c2nc(N(C)C(C)c2c[nH]nn2)c2ccccc23)no1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.37
RXFP1 Q9HBX9 6/20 0.35
KMT2A Q03164 3/20 0.35
MEN1 O00255 2/20 0.35
POLB P06746 5/20 0.34
TP53 P04637 4/20 0.34
KDM4E B2RXH2 4/20 0.34
MAPK1 P28482 3/20 0.32
ALDH1A1 P00352 3/20 0.32
HPGD P15428 1/20 0.32
HTT P42858 2/20 0.32
NPC1 O15118 1/20 0.32
RAB9A P51151 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32
GABRA1 P14867 4/20 0.31
GABRG2 P18507 4/20 0.31
GABRB3 P28472 4/20 0.31
GABRA5 P31644 4/20 0.31
GABRA3 P34903 4/20 0.31
GABRA2 P47869 4/20 0.31

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
SCHEMBL6068567 0.84 MAPT (0.36) MAPTRXFP1KMT2AMEN1POLB
SCHEMBL6068331 0.82 RXFP1 (0.36) MAPTRXFP1KMT2AMEN1POLB
SCHEMBL6068805 0.75 MAPT (0.41) MAPTRXFP1KMT2AMEN1POLB
SCHEMBL6068240 0.75 MAPT (0.40) MAPTRXFP1KMT2AMEN1POLB
SCHEMBL6068766 0.74 GABRA1 (0.40) MAPTRXFP1KMT2AMEN1POLB
SCHEMBL6068824 0.74 MAPT (0.38) MAPTRXFP1KMT2AMEN1POLB
SCHEMBL6068450 0.72 GABRA1 (0.46) MAPTRXFP1KMT2AMEN1POLB
SCHEMBL6068548 0.71 MAPT (0.39) MAPTRXFP1KMT2AMEN1POLB
SCHEMBL6068571 0.71 MAPT (0.41) MAPTRXFP1KMT2AMEN1POLB
SCHEMBL6068706 0.70 POLB (0.36) MAPTRXFP1KMT2AMEN1POLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7144887-B2 Substituted 1,2,3-triazolo[1,5-a]quinazolines for enhancing cognition MERCK SHARP & DOHME LTD. (GB) 2006-12-05 US claimed
US-7144887-B2 Substituted 1,2,3-triazolo[1,5-a]quinazolines for enhancing cognition MERCK SHARP & DOHME LTD. (GB) 2006-12-05 US disclosed