SCHEMBL7767141

SCHEMBL7767141

CCCCC[C](CCCCC)C(CCCC)CCCC

nearest known ligand 0.45

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CA2 P00918 7/20 0.45
MAPK1 P28482 1/20 0.44
CA1 P00915 4/20 0.43
CES2 O00748 4/20 0.42
CES1 P23141 4/20 0.42
DNM1 Q05193 2/20 0.42
AKR1B1 P15121 1/20 0.40
FFAR4 Q5NUL3 1/20 0.39
FFAR1 O14842 1/20 0.39
ALDH1A1 P00352 1/20 0.39
TSHR P16473 1/20 0.39
SLC22A6 Q4U2R8 1/20 0.39
SLC22A8 Q8TCC7 1/20 0.39
GPR84 Q9NQS5 1/20 0.39

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
SCHEMBL6252741 0.95 CA2 (0.52) CA2MAPK1CES2CES1DNM1
SCHEMBL15018263 0.95 CA2 (0.52) CA2MAPK1CES2CES1DNM1
SCHEMBL11159529 0.95 CA2 (0.52) CA2MAPK1CES2CES1DNM1
SCHEMBL16098364 0.93 CA2 (0.45) CA2MAPK1CA1CES2CES1
SCHEMBL18837647 0.93 CA2 (0.41) CA2MAPK1CA1CES2CES1
SCHEMBL23498813 0.92 CA2 (0.48) CA2CES2CES1FFAR4FFAR1
SCHEMBL7511263 0.92 CA2 (0.48) CA2CES2CES1FFAR4FFAR1
SCHEMBL10519624 0.92 CA2 (0.48) CA2CES2CES1FFAR4FFAR1
SCHEMBL7767174 0.92 CA2 (0.48) CA2CES2CES1FFAR4FFAR1
SCHEMBL16702733 0.92 CA2 (0.48) CA2CES2CES1FFAR4FFAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2001092420-A2 PERYLENE DYES WITH PERSISTENT FLUORESCENCE CAUSED BY STERIC INHIBITION OF AGGREGATION RADIANT COLOR N.V. (BE) 2001-12-06 WO claimed
WO-2001092420-A2 PERYLENE DYES WITH PERSISTENT FLUORESCENCE CAUSED BY STERIC INHIBITION OF AGGREGATION RADIANT COLOR N.V. (BE) 2001-12-06 WO disclosed