SCHEMBL10970010

SCHEMBL10970010

CCOC(=O)C(=CNc1nc(=O)n(C)c2ccccc12)C(=O)OCC

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 5/20 0.52
MAPT P10636 4/20 0.52
NPSR1 Q6W5P4 4/20 0.52
MAPK1 P28482 2/20 0.52
L3MBTL1 Q9Y468 1/20 0.52
CYP3A4 P08684 2/20 0.51
CYP2D6 P10635 2/20 0.51
CYP1A2 P05177 1/20 0.51
CYP2C19 P33261 1/20 0.51
MEN1 O00255 3/20 0.49
KMT2A Q03164 3/20 0.49
DHODH Q02127 4/20 0.49
GAA P10253 2/20 0.49
LMNA P02545 2/20 0.46
STAT1 P42224 1/20 0.46
ALDH1A1 P00352 2/20 0.45
TDP1 Q9NUW8 1/20 0.43
GABRP O00591 1/20 0.43
GABRD O14764 1/20 0.43
GABRA1 P14867 1/20 0.43

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
SCHEMBL11098958 0.83 KMT2A (0.38) KDM4EMAPTCYP2C19MEN1KMT2A
SCHEMBL10971806 0.76 MAPT (0.55) KDM4EMAPTNPSR1MAPK1L3MBTL1
SCHEMBL10970247 0.75 MAPT (0.54) KDM4EMAPTNPSR1MAPK1L3MBTL1
SCHEMBL10970373 0.75 MAPT (0.54) KDM4EMAPTNPSR1MAPK1L3MBTL1
SCHEMBL11610004 0.74 MAPT (0.65) KDM4EMAPTNPSR1MAPK1L3MBTL1
SCHEMBL10970489 0.74 MAPT (0.52) KDM4EMAPTNPSR1MAPK1L3MBTL1
SCHEMBL10969377 0.73 MAPT (0.51) KDM4EMAPTNPSR1MAPK1L3MBTL1
SCHEMBL10967972 0.71 RAB9A (0.59) KDM4EMAPTNPSR1MAPK1L3MBTL1
SCHEMBL11608951 0.70 MAPT (0.56) KDM4EMAPTNPSR1MAPK1L3MBTL1
SCHEMBL10973850 0.70 MAPT (0.50) KDM4EMAPTNPSR1MAPK1L3MBTL1

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-4543356-A Quinazoline derivatives FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1985-09-24 US disclosed