SCHEMBL5556663

SCHEMBL5556663

CCN(CC)c1ccc(C(c2ccc(Br)cc2)c2ccc(N(CC)CC)cc2C)c(C)c1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ S100B P04271 1/20 0.50
▸ POLB P06746 3/20 0.41
▸ GRK2 P25098 1/20 0.41
▸ DNMT1 P26358 1/20 0.41
▸ CTDSP1 Q9GZU7 1/20 0.41
▸ GRK6 P43250 1/20 0.40
▸ MAPT P10636 5/20 0.40
▸ GAA P10253 2/20 0.40
▸ PKM P14618 1/20 0.40
▸ HTT P42858 1/20 0.40
▸ MCL1 Q07820 1/20 0.40
▸ MAPK1 P28482 7/20 0.37
▸ KMT2A Q03164 5/20 0.37
▸ MEN1 O00255 4/20 0.37
▸ GFER P55789 2/20 0.37
▸ ALOX15 P16050 1/20 0.37
▸ ATM Q13315 2/20 0.37
▸ LMNA P02545 2/20 0.37
▸ SMN1; SMN2 Q16637 2/20 0.37
▸ TP53 P04637 1/20 0.37

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
SCHEMBL10952039 0.92 S100B (0.53) S100BGRK6MAPTGAAPKM
SCHEMBL658351 0.91 S100B (0.51) S100BGRK6MAPTGAAPKM
SCHEMBL5556669 0.88 S100B (0.46) S100BPOLBGRK2DNMT1CTDSP1
SCHEMBL215745 0.88 S100B (0.49) S100BGRK6MAPTGAAPKM
SCHEMBL29371256 0.88 S100B (0.49) S100BGRK6MAPTGAAPKM
SCHEMBL13804083 0.87 S100B (0.51) S100BGRK6MAPTGAAPKM
SCHEMBL656825 0.87 S100B (0.51) S100BGRK6MAPTGAAPKM
SCHEMBL11105809 0.86 S100B (0.47) S100BGRK6MAPTGAAPKM
SCHEMBL5555826 0.86 S100B (0.47) S100BGRK6MAPTGAAPKM
SCHEMBL6248420 0.86 S100B (0.47) S100BGRK6MAPTGAAPKM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1803034-A2 HOLOGRAPHIC STORAGE MEDIUM General Electric Company (US) 2007-07-04 — — EP disclosed
WO-2006044243-A2 HOLOGRAPHIC STORAGE MEDIUM GENERAL ELECTRIC COMPANY A CORPORATION OF THE STATE OF NEW YORK (US) 2006-04-27 — — WO disclosed
US-20060078802-A1 Holographic storage medium SABIC INNOVATIVE PLASTICS IP B.V. 2006-04-13 — — US disclosed
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