SCHEMBL28590262

SCHEMBL28590262

c1csc(-c2cccc3[nH]c4ccccc4c23)c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
IMPDH2 P12268 1/20 0.47
IMPDH1 P20839 1/20 0.47
PARP1 P09874 2/20 0.46
TDO2 P48775 1/20 0.46
UTS2R Q9UKP6 1/20 0.43
KDM4E B2RXH2 3/20 0.43
GABRP O00591 1/20 0.42
GABRD O14764 1/20 0.42
GABRA1 P14867 1/20 0.42
GABRB1 P18505 1/20 0.42
GABRG2 P18507 1/20 0.42
GABRB3 P28472 1/20 0.42
GABRA5 P31644 1/20 0.42
GABRA3 P34903 1/20 0.42
GABRA2 P47869 1/20 0.42
GABRB2 P47870 1/20 0.42
GABRA4 P48169 1/20 0.42
GABRE P78334 1/20 0.42
GABRA6 Q16445 1/20 0.42
GABRG1 Q8N1C3 1/20 0.42

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
SCHEMBL28688369 0.81 KIF11 (0.50) PARP1TDO2KDM4EGABRPGABRD
SCHEMBL5933739 0.80 IMPDH2 (0.63) IMPDH2IMPDH1PARP1KDM4EGABRP
SCHEMBL866840 0.78 IMPDH2 (0.61) IMPDH2IMPDH1PARP1KDM4EGABRP
SCHEMBL1326375 0.78 IMPDH2 (0.61) IMPDH2IMPDH1PARP1KDM4EGABRP
SCHEMBL7212806 0.75 KDM4E (0.50) PARP1TDO2KDM4EALDH1A1HSD17B10
SCHEMBL8987234 0.73 HPGD (0.57) PARP1TDO2KDM4EALDH1A1HSD17B10
SCHEMBL1669833 0.73 IMPDH2 (0.55) IMPDH2IMPDH1PARP1KDM4EGABRP
SCHEMBL20261907 0.73 IMPDH2 (0.55) IMPDH2IMPDH1PARP1KDM4EGABRP
SCHEMBL31664385 0.73 IMPDH2 (0.55) IMPDH2IMPDH1PARP1KDM4EGABRP
SCHEMBL1177888 0.73 IMPDH2 (0.55) IMPDH2IMPDH1PARP1KDM4EGABRP

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112512808-B Infrared shielding laminate and method for producing same 株式会社可乐丽 2023-05-23 CN disclosed
CN-115557956-A Large condensed ring organic compound, application thereof and organic electroluminescent device comprising large condensed ring organic compound 北京鼎材科技有限公司 2023-01-03 CN disclosed
CN-115557956-A Large condensed ring organic compound, application thereof and organic electroluminescent device comprising large condensed ring organic compound 北京鼎材科技有限公司 2023-01-03 CN disclosed
CN-113061146-A Organic compound and electroluminescent application thereof 上海天马有机发光显示技术有限公司 2021-07-02 CN disclosed