SCHEMBL9256353

SCHEMBL9256353

CCOC(=O)N1C(c2cnc3cccc(C)n3c2=O)=NNN1C

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 5/20 0.36
GAA P10253 3/20 0.34
PDE5A O76074 2/20 0.34
GABRP O00591 1/20 0.33
GABRD O14764 1/20 0.33
GABRA1 P14867 1/20 0.33
GABRB1 P18505 1/20 0.33
GABRG2 P18507 1/20 0.33
GABRB3 P28472 1/20 0.33
GABRA5 P31644 1/20 0.33
GABRA3 P34903 1/20 0.33
GABRA2 P47869 1/20 0.33
GABRB2 P47870 1/20 0.33
GABRA4 P48169 1/20 0.33
GABRE P78334 1/20 0.33
GABRA6 Q16445 1/20 0.33
GABRG1 Q8N1C3 1/20 0.33
GABRG3 Q99928 1/20 0.33
GABRQ Q9UN88 1/20 0.33
GLA P06280 2/20 0.33

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
SCHEMBL9276531 0.83 MAPT (0.43) KDM4EGAAGLAHTTMEN1
SCHEMBL11248747 0.71 KDM4E (0.60) KDM4EGAAGLAHTTMEN1
SCHEMBL9262209 0.69 MAPT (0.43) KDM4EGAAGLAHTTMEN1
SCHEMBL9256348 0.69 MAPK1 (0.46) KDM4EGAAHTTMEN1KMT2A
SCHEMBL7875409 0.67 GAA (0.51) KDM4EGAAGABRA1GABRA2GABRB2
SCHEMBL9382960 0.66 HTT (0.42) KDM4EGAAPDE5AGLAHTT
SCHEMBL9255169 0.65 CYP1A2 (0.43) HTTMEN1KMT2AALDH1A1
SCHEMBL9263794 0.64 HTT (0.40) KDM4EHTTPOLBALDH1A1HPGD
SCHEMBL9263856 0.64 HTT (0.38) KDM4EPDE5AGLAHTTMEN1
SCHEMBL10518789 0.64 HTT (0.51) KDM4EGAAPDE5AHTTPOLB

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-5475000-A Antiulcer agents CHINOIN GYOGYSZER-ES VEGYESZETI TERMEKEK GYARA RT. (HU) 1995-12-12 US disclosed