SCHEMBL6307036

SCHEMBL6307036

Cc1ccc2nc(-c3ccc4ccccc4c3)n(CCCN)c(=O)c2c1

nearest known ligand 0.55

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
GHSR Q92847 5/20 0.55
ALDH1A1 P00352 4/20 0.48
MAPT P10636 2/20 0.48
HPGD P15428 2/20 0.48
MAPK1 P28482 1/20 0.48
RXFP1 Q9HBX9 1/20 0.48
EGFR P00533 1/20 0.47
ABCC1 P33527 1/20 0.46
POLB P06746 1/20 0.46
KDM4E B2RXH2 2/20 0.46
LMNA P02545 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
MEN1 O00255 2/20 0.45
KMT2A Q03164 2/20 0.45
F11 P03951 1/20 0.45

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
SCHEMBL6394256 0.90 EGFR (0.55) GHSRALDH1A1MAPTHPGDMAPK1
SCHEMBL6307779 0.90 EGFR (0.57) ALDH1A1MAPTHPGDMAPK1RXFP1
SCHEMBL6308188 0.89 GHSR (0.54) GHSRMAPTEGFRABCC1F11
SCHEMBL6308112 0.89 KMT2A (0.50) GHSRRXFP1EGFRPOLBSMN1; SMN2
SCHEMBL6306926 0.88 MEN1 (0.50) ALDH1A1MAPTHPGDMAPK1RXFP1
SCHEMBL6307622 0.88 F11 (0.59) GHSRALDH1A1MAPTHPGDMAPK1
SCHEMBL6314165 0.88 GHSR (0.61) GHSRMAPTMAPK1RXFP1EGFR
SCHEMBL6309608 0.87 GHSR (0.43) GHSRALDH1A1MAPTHPGDMAPK1
SCHEMBL6306850 0.84 F11 (0.59) ALDH1A1MAPTHPGDMAPK1RXFP1
SCHEMBL6314931 0.84 F11 (0.52) ALDH1A1MAPTHPGDMAPK1RXFP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6890930-B1 Quinazolinones 3-DIMENSIONAL PHARMACEUTICALS, INC. (US) 2005-05-10 US disclosed
EP-1216235-A1 QUINAZOLINONES MERCK PATENT GmbH (DE) 2002-06-26 EP disclosed
WO-2001023365-A1 QUINAZOLINONES MERCK PATENT GMBH (DE) 2001-04-05 WO disclosed