SCHEMBL9718511

SCHEMBL9718511

CCN(c1ccc(C(c2ccc(N(CC)C(C)O)cc2C)C(C)C)c(C)c1)C(C)O

nearest known ligand 0.39

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
S1PR1 P21453 8/20 0.39
IGLV6-57 P01721 1/20 0.36
S100B P04271 1/20 0.33
GAA P10253 1/20 0.33
MAPT P10636 1/20 0.33
PKM P14618 1/20 0.33
HTT P42858 1/20 0.33
MCL1 Q07820 1/20 0.33
RXRA P19793 1/20 0.31
RXRB P28702 1/20 0.31
RXRG P48443 1/20 0.31
CRHR1 P34998 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
SCHEMBL13967036 0.82 S1PR1 (0.42) S1PR1IGLV6-57S100BMAPTCRHR1
SCHEMBL9449699 0.80 S100B (0.53) S1PR1IGLV6-57S100BGAAMAPT
SCHEMBL11324192 0.80 MAPT (0.40) S1PR1IGLV6-57GAAMAPTPKM
SCHEMBL11582672 0.79 ESR1 (0.42) S1PR1IGLV6-57S100B
SCHEMBL793451 0.78 S100B (0.59) S1PR1IGLV6-57S100BGAACRHR1
SCHEMBL11114625 0.78 S100B (0.59) S1PR1IGLV6-57S100BGAACRHR1
Hydrochloric Acid SCHEMBL11575193 0.76 S100B (0.57) S1PR1IGLV6-57S100BGAACRHR1
SCHEMBL9718514 0.76 MAPT (0.51) S1PR1IGLV6-57S100BGAAMAPT
SCHEMBL8593641 0.75 ESR1 (0.39) S1PR1IGLV6-57S100BGAAMAPT
SCHEMBL9446313 0.74 IGLV6-57 (0.41) S1PR1IGLV6-57S100BGAAMAPT

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-4258112-A AROMATIC AMINES, ISOBENZOFURANS OR JULOLIDINE, PHOTOSENSITIVE PIGMENT EASTMAN KODAK COMPANY (US) 1981-03-24 US claimed
EP-0010450-A1 Sensitized electrophoretic migration imaging dispersion and process EASTMAN KODAK COMPANY (a New Jersey corporation) (US) 1980-04-30 EP claimed
US-5080989-A Polycarbonate, solvent resistance EASTMAN KODAK COMPANY (US) 1992-01-14 US disclosed
US-4361636-A COLORANT EASTMAN KODAK COMPANY (US) 1982-11-30 US disclosed
EP-0064007-A1 Ionic polyesters, electrically photosensitive composite particles and materials containing the polyesters and photoelectrophoretic imaging methods EASTMAN KODAK COMPANY (a New Jersey corporation) (US) 1982-11-03 EP disclosed
US-4322487-A Composite electrically photosensitive particles for electrophoretic migration imaging process EASTMAN KODAK COMPANY (US) 1982-03-30 US disclosed