SCHEMBL7796780

SCHEMBL7796780

CCCCCCCCCCCCCCCCCCC1=NC(CC)CO1

nearest known ligand 0.47

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.34
ATM Q13315 1/20 0.33
THRA P10827 1/20 0.33
THRB P10828 1/20 0.33
NOS1 P29475 1/20 0.32
NOS2 P35228 1/20 0.32
KCNH2 Q12809 1/20 0.32
SPHK2 Q9NRA0 4/20 0.30
SPHK1 Q9NYA1 3/20 0.30
TDP1 Q9NUW8 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
SCHEMBL10491958 1.00 ALDH1A1 (0.34) ALDH1A1ATMTHRATHRBNOS1
SCHEMBL10491908 1.00 ALDH1A1 (0.34) ALDH1A1ATMTHRATHRBNOS1
SCHEMBL10492103 1.00 ALDH1A1 (0.34) ALDH1A1ATMTHRATHRBNOS1
SCHEMBL10359212 1.00 ALDH1A1 (0.34) ALDH1A1ATMTHRATHRBNOS1
SCHEMBL9787945 1.00 ALDH1A1 (0.34) ALDH1A1ATMTHRATHRBNOS1
SCHEMBL10616829 1.00 ALDH1A1 (0.34) ALDH1A1ATMTHRATHRBNOS1
SCHEMBL10621233 1.00 ALDH1A1 (0.34) ALDH1A1ATMTHRATHRBNOS1
SCHEMBL8968041 1.00 ALDH1A1 (0.34) ALDH1A1ATMTHRATHRBNOS1
SCHEMBL10491961 1.00 ALDH1A1 (0.34) ALDH1A1ATMTHRATHRBNOS1
SCHEMBL10491807 1.00 ALDH1A1 (0.34) ALDH1A1ATMTHRATHRBNOS1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6059871-A MIXTURE OF VEHICLE, COLORANT AND CRYSTAL GROWTH INHIBITOR XEROX CORPORATION (US) 2000-05-09 US claimed
US-5989325-A ACOUSTIC PRINTING HOT MELT INK COMPRISING NONAQUEOUS MIXTURE OF A COLORANT, A VEHICLE AND A PHENYLCYCLOHEXANOL DERIVATIVE HYDROPHOBIC GELLING AGENT XEROX CORPORATION (US) 1999-11-23 US claimed
US-5698017-A INCLUDES AN AMIDE OR AMINO ESTER XEROX CORPORATION (US) 1997-12-16 US claimed
EP-0832948-B1 Oxazoline hot melt ink compositions XEROX CORP (US) 2001-12-05 EP disclosed
US-6059871-A MIXTURE OF VEHICLE, COLORANT AND CRYSTAL GROWTH INHIBITOR XEROX CORPORATION (US) 2000-05-09 US disclosed
US-5989325-A ACOUSTIC PRINTING HOT MELT INK COMPRISING NONAQUEOUS MIXTURE OF A COLORANT, A VEHICLE AND A PHENYLCYCLOHEXANOL DERIVATIVE HYDROPHOBIC GELLING AGENT XEROX CORPORATION (US) 1999-11-23 US disclosed
US-5817169-A MIXTURE OF COLORANT AND VEHICLE CONTAINING AMIDE AND AMINOESTER XEROX CORPORATION (US) 1998-10-06 US disclosed
EP-0832948-A1 Oxazoline hot melt ink compositions XEROX CORPORATION (US) 1998-04-01 EP disclosed
US-5698017-A INCLUDES AN AMIDE OR AMINO ESTER XEROX CORPORATION (US) 1997-12-16 US disclosed