SCHEMBL8879965

SCHEMBL8879965

CCOC(=O)c1nccn1C1Cc2ccccc2C1=O

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.46
MAPK1 P28482 1/20 0.46
ATM Q13315 1/20 0.46
GABRA1 P14867 3/20 0.43
GABRG2 P18507 3/20 0.43
GABRB3 P28472 3/20 0.43
GABRA5 P31644 3/20 0.43
GABRA3 P34903 3/20 0.43
GABRP O00591 2/20 0.43
GABRD O14764 2/20 0.43
GABRB1 P18505 2/20 0.43
GABRA2 P47869 2/20 0.43
GABRB2 P47870 2/20 0.43
GABRA4 P48169 2/20 0.43
GABRE P78334 2/20 0.43
GABRA6 Q16445 2/20 0.43
GABRG1 Q8N1C3 2/20 0.43
GABRG3 Q99928 2/20 0.43
GABRQ Q9UN88 2/20 0.43
ALDH1A1 P00352 3/20 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
SCHEMBL8880656 0.87 METAP1 (0.38) MAPTMAPK1ATMGABRA1GABRG2
SCHEMBL8880066 0.85 HRH1 (0.43) MAPTMAPK1GABRA1GABRG2GABRB3
SCHEMBL8881385 0.85 GABRG2 (0.41) MAPTMAPK1ATMGABRA1GABRG2
SCHEMBL8880563 0.85 GABRG2 (0.38) MAPTGABRA1GABRG2GABRB3GABRA5
SCHEMBL8880818 0.85 ACHE (0.41) MAPTMAPK1ATMGABRA1GABRG2
SCHEMBL8882302 0.85 GABRG2 (0.40) MAPTMAPK1GABRA1GABRG2GABRB3
SCHEMBL8097517 0.85 KMT2A (0.43) MAPK1GABRA1GABRG2GABRB3GABRA5
SCHEMBL8881566 0.85 ACHE (0.40) MAPTMAPK1ATMGABRA1GABRG2
SCHEMBL8883880 0.84 RAB9A (0.39) MAPTMAPK1ATMGABRA1GABRG2
SCHEMBL8881176 0.84 CYP19A1 (0.43) MAPTMAPK1GABRA1GABRG2GABRB3

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-5677306-A ANTAGONIZING ALPHA-AMINO-3-HYDROXY-5-METHYL-4-ISOXAZOLEPROPIONIC ACID RECEPTOR, USEFUL FOR TREATING ALL ISCHEMIAS RHONE-POULENC RORER S.A. (FR) 1997-10-14 US disclosed