SCHEMBL14560729

SCHEMBL14560729

Cc1cc(C)c(-c2cc(-c3ccccc3)c3ccc4c(-c5ccccc5)cc(-c5c(C)cc(C)cc5C5CCCCC5)nc4c3n2)c(C2CCCCC2)c1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PSMB5 P28074 2/20 0.41
▸ ADORA1 P30542 4/20 0.38
▸ ADORA3 P0DMS8 2/20 0.38
▸ ADORA2B P29275 2/20 0.38
▸ ADORA2A P29274 2/20 0.38
▸ NPY5R Q15761 1/20 0.37
▸ PDK2 Q15119 1/20 0.35
▸ PDK4 Q16654 1/20 0.35
▸ TDP1 Q9NUW8 1/20 0.34
▸ L3MBTL1 Q9Y468 1/20 0.34
▸ CAMKK2 Q96RR4 1/20 0.34
▸ CASP3 P42574 2/20 0.34
▸ SENP7 Q9BQF6 2/20 0.34
▸ SENP6 Q9GZR1 2/20 0.34
▸ KDM4E B2RXH2 2/20 0.33
▸ LMNA P02545 2/20 0.33
▸ PTGS2 P35354 1/20 0.33
▸ MEN1 O00255 1/20 0.33
▸ ALDH1A1 P00352 1/20 0.33
▸ MAPT P10636 1/20 0.33

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
SCHEMBL14560725 0.87 PDK2 (0.41) PSMB5ADORA1ADORA3ADORA2BADORA2A
SCHEMBL14560740 0.84 ADORA1 (0.40) PSMB5ADORA1ADORA3ADORA2BADORA2A
SCHEMBL14560738 0.84 ADORA1 (0.38) PSMB5ADORA1ADORA3ADORA2BADORA2A
SCHEMBL14560727 0.83 MAPT (0.40) PSMB5ADORA1ADORA3ADORA2BADORA2A
SCHEMBL14560702 0.82 PSMB5 (0.49) PSMB5ADORA1ADORA3ADORA2ATDP1
SCHEMBL14560741 0.81 ADORA1 (0.39) PSMB5ADORA1ADORA3ADORA2BADORA2A
SCHEMBL14560726 0.81 CASP3 (0.40) PSMB5ADORA1ADORA3ADORA2BADORA2A
SCHEMBL14560730 0.81 ADORA1 (0.39) PSMB5ADORA1ADORA3ADORA2BADORA2A
SCHEMBL13458759 0.80 PSMB5 (0.47) PSMB5ADORA1ADORA2ATDP1L3MBTL1
SCHEMBL14560760 0.80 PSMB5 (0.47) PSMB5TDP1L3MBTL1KDM4ELMNA

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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