SCHEMBL7188922

SCHEMBL7188922

COC(=O)c1cc(OC)ccc1C(c1ccc(N(C)C)cc1C)c1c(-c2ccccc2)n(C)c2ccccc12

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GABRG2 P18507 4/20 0.44
GABRB3 P28472 4/20 0.44
GABRA3 P34903 4/20 0.44
GABRA2 P47869 3/20 0.44
GABRA1 P14867 3/20 0.44
GABRA5 P31644 1/20 0.41
KMT2A Q03164 3/20 0.39
MEN1 O00255 1/20 0.39
MAPT P10636 1/20 0.37
PLA2G2A P14555 1/20 0.37
L3MBTL1 Q9Y468 4/20 0.36
NTRK1 P04629 1/20 0.36
ALDH1A1 P00352 2/20 0.35
HPGD P15428 2/20 0.35
GLA P06280 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
KDM4E B2RXH2 1/20 0.35
USP2 O75604 1/20 0.35
HSD17B10 Q99714 1/20 0.35
ATM Q13315 1/20 0.35

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
SCHEMBL7181940 0.92 GABRG2 (0.46) GABRG2GABRB3GABRA3GABRA2GABRA1
SCHEMBL7188506 0.76 GABRA1 (0.45) GABRG2GABRB3GABRA3GABRA2GABRA1
SCHEMBL7187904 0.74 NR4A2 (0.38) GABRG2GABRB3GABRA3GABRA2GABRA1
SCHEMBL9665847 0.73 GABRG2 (0.39) GABRG2GABRB3GABRA3GABRA2GABRA1
SCHEMBL7193629 0.69 KDM4E (0.38) GABRG2GABRB3GABRA3GABRA2GABRA1
SCHEMBL12765062 0.69 ATM (0.36) KMT2AMEN1MAPTL3MBTL1ALDH1A1
SCHEMBL18351210 0.69 ALDH1A1 (0.45) MAPTL3MBTL1ALDH1A1HPGDKDM4E
SCHEMBL10760794 0.68 SLC2A1 (0.48) GABRG2GABRB3GABRA3GABRA2KMT2A
SCHEMBL7185303 0.67 PTGER4 (0.36) GABRG2GABRB3GABRA3GABRA2GABRA1
SCHEMBL7181782 0.66 MAPT (0.38) GABRG2GABRB3GABRA3GABRA2GABRA1

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-6586364-B2 Shell walls; liquid coloring PENTAX CORPORATION (JP) 2003-07-01 US disclosed
US-20020168580-A1 Heat-sensitive microcapsule and recording medium using same ASAHI KOGAKU KOGYO KABUSHIKI KAISHA 2002-11-14 US disclosed