SCHEMBL14560734

SCHEMBL14560734

Cc1c(-c2cc(-c3ccccc3)c3ccc4c(-c5ccccc5)cc(-c5cccc(C6CCCCC6)c5C)nc4c3n2)cccc1C1CCCCC1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PDK2 Q15119 1/20 0.41
▸ PDK4 Q16654 1/20 0.41
▸ PTGS2 P35354 1/20 0.40
▸ ADORA1 P30542 3/20 0.39
▸ ADORA3 P0DMS8 2/20 0.39
▸ ADORA2B P29275 2/20 0.39
▸ ADORA2A P29274 2/20 0.39
▸ CASP3 P42574 2/20 0.36
▸ SENP7 Q9BQF6 2/20 0.36
▸ SENP6 Q9GZR1 2/20 0.36
▸ POLB P06746 2/20 0.36
▸ CHRNB2 P17787 1/20 0.36
▸ CHRNA4 P43681 1/20 0.36
▸ TDP1 Q9NUW8 1/20 0.36
▸ L3MBTL1 Q9Y468 1/20 0.36
▸ NPY5R Q15761 1/20 0.36
▸ PTPN5 P54829 3/20 0.35
▸ PTPN2 P17706 1/20 0.35
▸ MEN1 O00255 1/20 0.34
▸ ALDH1A1 P00352 1/20 0.34

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
SCHEMBL14560724 0.89 PTGS2 (0.44) PDK2PDK4PTGS2ADORA1ADORA3
SCHEMBL14560738 0.86 ADORA1 (0.38) PDK2PDK4PTGS2ADORA1ADORA3
SCHEMBL14560726 0.85 CASP3 (0.40) PDK2PDK4PTGS2ADORA1ADORA3
SCHEMBL14560725 0.84 PDK2 (0.41) PDK2PDK4PTGS2ADORA1ADORA3
SCHEMBL14560727 0.83 MAPT (0.40) PDK2PDK4PTGS2ADORA1ADORA3
SCHEMBL14560741 0.83 ADORA1 (0.39) PDK2PDK4PTGS2ADORA1ADORA3
SCHEMBL14560728 0.83 ADORA1 (0.39) PDK2PDK4ADORA1ADORA3ADORA2B
SCHEMBL14560755 0.80 PDCD1 (0.43) MEN1ALDH1A1KMT2APDCD1CD274
SCHEMBL14560729 0.79 PSMB5 (0.41) PDK2PDK4PTGS2ADORA1ADORA3
SCHEMBL10295460 0.78 S1PR1 (0.40) PDK2ADORA1ADORA3ADORA2BADORA2A

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-7186469-B2 Bathophenanthroline compound and EL device SONY CORPORATION (JP) 2007-03-06 — — US disclosed
US-7186469-B2 Bathophenanthroline compound and EL device SONY CORPORATION (JP) 2007-03-06 — — US disclosed
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