SCHEMBL5007883

SCHEMBL5007883

CCN(CC)CCC(C)Nc1ccc(C(c2ccccc2Cl)c2ccc(NC(C)CCN(CC)CC)cc2Cl)c(Cl)c1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CCR4 P51679 7/20 0.49
MAPT P10636 2/20 0.42
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42
CACNA2D1 P54289 5/20 0.39
GAA P10253 1/20 0.39
PKM P14618 1/20 0.39
HTT P42858 1/20 0.39
MCL1 Q07820 1/20 0.39
KCNH3 Q9ULD8 1/20 0.39
CYP2D6 P10635 1/20 0.37
CYP2C19 P33261 1/20 0.37
TDP1 Q9NUW8 1/20 0.37
PRNP P04156 1/20 0.37
APP P05067 1/20 0.37
CHRM2 P08172 1/20 0.37
CHRM4 P08173 1/20 0.37
CHRM5 P08912 1/20 0.37
ADRA2A P08913 1/20 0.37
CHRM1 P11229 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
SCHEMBL11273183 0.81 CCR4 (0.38) CCR4MAPTMEN1KMT2ACACNA2D1
SCHEMBL3903276 0.72 MAPT (0.63) MAPTMEN1KMT2AGAAPKM
SCHEMBL5009568 0.69 GAA (0.45) MAPTMEN1KMT2AGAAPKM
SCHEMBL10887190 0.67 CCR4 (0.47) CCR4HTTTDP1SIGMAR1
SCHEMBL11273187 0.67 MAPT (0.40) MAPTMEN1KMT2AGAAPKM
SCHEMBL13664857 0.65 UBE2M (0.41) CCR4MEN1KMT2AGAAHTT
SCHEMBL3903278 0.65 MAPT (0.36) CCR4MAPTMEN1KMT2AGAA
SCHEMBL12744490 0.64 ALDH1A1 (0.63) CCR4MAPTMEN1KMT2AGAA
SCHEMBL14568564 0.63 CCR4 (0.48) CCR4CACNA2D1KCNH3
SCHEMBL2066643 0.62 TSHR (0.53) MAPTMEN1KMT2AGAAPKM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080311524-A1 Method For Making Negative-Working Heat-Sensitive Lithographic Printing Plate Precursor AGFA GRAPHICS N.V. (BE) 2008-12-18 US disclosed
US-20060078802-A1 Holographic storage medium SABIC INNOVATIVE PLASTICS IP B.V. 2006-04-13 US disclosed
US-4857438-A Photochromic system and layers produced therewith BASF AKTIENGESELLSCHAFT (DE) 1989-08-15 US disclosed
US-4315068-A CONTAINING A COBALT-AMMINE COMPLEX AND A DIOXIME OR A BISIMIDAZOLIN-3-ONE CHELATING AGENT; STABILITY; COLOR DILMS RICOH CO., LTD. (JP) 1982-02-09 US disclosed
US-4251619-A Process for forming photo-polymeric image KONISHIROKU PHOTO INDUSTRY CO., LTD. (JP) 1981-02-17 US disclosed
US-4139390-A Presensitized printing plate having a print-out image EASTMAN KODAK COMPANY (US) 1979-02-13 US disclosed