SCHEMBL7029003

SCHEMBL7029003

CCN(CC)c1cc[c]c2ccc(Cl)cc12

nearest known ligand 0.35

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CCR5 P51681 1/20 0.35
PGR P06401 1/20 0.33
ALDH1A1 P00352 1/20 0.32
GAA P10253 1/20 0.32
MAPT P10636 1/20 0.32
HTT P42858 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32
CRHR1 P34998 3/20 0.30
CNR2 P34972 1/20 0.30
TP53 P04637 1/20 0.30
LATS1 O95835 1/20 0.30
KDM4E B2RXH2 1/20 0.30
MAPK1 P28482 1/20 0.30

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
SCHEMBL297213 0.77 AR (0.33) ALDH1A1MAPTCNR2MAPK1
SCHEMBL7790807 0.70 TP53 (0.39) ALDH1A1TP53MAPK1
SCHEMBL297736 0.69 AR (0.33) ALDH1A1MAPTHTTMAPK1
SCHEMBL11695239 0.67 CYP3A4 (0.43) CCR5PGRGAACRHR1TP53
SCHEMBL23555163 0.66 CCR5 (0.39) CCR5PGRALDH1A1GAACRHR1
SCHEMBL27879312 0.66 CYP3A4 (0.45) CCR5ALDH1A1MAPTHTTMAPK1
SCHEMBL3992210 0.66 CCR5 (0.39) CCR5PGRALDH1A1GAAMAPT
SCHEMBL8381530 0.66 ACP1 (0.42) ALDH1A1GAAHTTKDM4EMAPK1
SCHEMBL26534113 0.65 NPY5R (0.47) ALDH1A1HTTCRHR1KDM4EMAPK1
SCHEMBL28957262 0.63 POLB (0.40) ALDH1A1GAATP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1288710-A1 Thermally developable infrared sensitive imaging materials containing heat-bleachable antihalation composition EASTMAN KODAK COMPANY (US) 2003-03-05 EP disclosed
US-6514677-B1 Thermally developable infrared sensitive imaging materials containing heat-bleachable antihalation composition EASTMAN KODAK COMPANY 2003-02-04 US disclosed
US-5676884-A Nonlinear optical materials containing polar disulfone-functionalized molecules MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1997-10-14 US disclosed
US-5578251-A NONLINEAR-OPTICAL RESPONSE; ALKYLATION MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1996-11-26 US disclosed
US-5360582-A Compositions with polymers for light sensitive elements MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1994-11-01 US disclosed
EP-0594697-A1 NONLINEAR OPTICAL MATERIALS CONTAINING POLAR DISULFONE-FUNCTIONALIZED MOLECULES MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1994-05-04 EP disclosed
WO-1993002383-A1 NONLINEAR OPTICAL MATERIALS CONTAINING POLAR DISULFONE-FUNCTIONALIZED MOLECULES MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1993-02-04 WO disclosed