SCHEMBL17522039

SCHEMBL17522039

c1ccc(-n2c3ccc(-c4ccc(-c5ccc6ccc7c(-c8ccccn8)ccc8ccc5c6c87)cc4)cc3c3cccnc32)cc1

nearest known ligand 0.38

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 1/20 0.38
▸ TSHR P16473 1/20 0.38
▸ CYP2C19 P33261 1/20 0.38
▸ FEN1 P39748 1/20 0.34
▸ NPY5R Q15761 1/20 0.33
▸ MAPK14 Q16539 1/20 0.33
▸ GRM5 P41594 2/20 0.32
▸ PDE4A P27815 2/20 0.32
▸ PDE4B Q07343 2/20 0.32
▸ PDE4C Q08493 2/20 0.32
▸ PDE4D Q08499 2/20 0.32
▸ PDE10A Q9Y233 1/20 0.32
▸ DHODH Q02127 1/20 0.31
▸ PIK3CA P42336 1/20 0.31
▸ PIM1 P11309 1/20 0.31
▸ PIM3 Q86V86 1/20 0.31
▸ PDE1A P54750 1/20 0.31
▸ PDE1B Q01064 1/20 0.31
▸ MAT2A P31153 1/20 0.31

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
SCHEMBL17522025 0.96 ALDH1A1 (0.39) ALDH1A1TSHRCYP2C19FEN1NPY5R
SCHEMBL17522051 0.95 ALDH1A1 (0.38) ALDH1A1TSHRCYP2C19FEN1NPY5R
SCHEMBL17522028 0.93 ALDH1A1 (0.44) ALDH1A1TSHRCYP2C19FEN1PDE4A
SCHEMBL20276098 0.91 KDM4E (0.38) NPY5RMAPK14GRM5DHODHPIK3CA
SCHEMBL17522023 0.90 MAT2A (0.34) ALDH1A1NPY5RMAPK14MAT2A
SCHEMBL17522049 0.90 ALDH1A1 (0.44) ALDH1A1TSHRCYP2C19FEN1PDE4A
SCHEMBL17522050 0.89 ALDH1A1 (0.44) ALDH1A1TSHRCYP2C19FEN1PDE4A
SCHEMBL20276056 0.87 KDM4E (0.38) TSHRCYP2C19NPY5RMAPK14GRM5
SCHEMBL17522020 0.86 ALDH1A1 (0.41) ALDH1A1TSHRCYP2C19FEN1PDE4A
SCHEMBL20276075 0.86 L3MBTL1 (0.40) TSHRNPY5RMAPK14GRM5DHODH

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-20160043327-A1 ORGANIC LIGHT EMITTING DISPLAY DEVICE LG DISPLAY CO., LTD. (KR) 2016-02-11 — — US disclosed
US-20160043327-A1 ORGANIC LIGHT EMITTING DISPLAY DEVICE LG DISPLAY CO., LTD. (KR) 2016-02-11 — — US disclosed
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