SCHEMBL5013002

SCHEMBL5013002

CCCCCCCCCCCCCCCCCCSc1cc(C)c(O)c(C)c1

nearest known ligand 0.55

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
THRB P10828 9/20 0.55
ESR1 P03372 2/20 0.49
GPR84 Q9NQS5 8/20 0.42
THRA P10827 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
PLK1 P53350 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
SCHEMBL18399905 1.00 THRB (0.55) THRBESR1GPR84THRASMN1; SMN2
SCHEMBL200878 1.00 THRB (0.55) THRBESR1GPR84THRASMN1; SMN2
SCHEMBL12326346 0.98 THRB (0.52) THRBESR1GPR84THRASMN1; SMN2
SCHEMBL201332 0.92 THRB (0.47) THRBESR1GPR84SMN1; SMN2
SCHEMBL30543181 0.90 THRB (0.50) THRBESR1GPR84THRA
SCHEMBL6025135 0.90 THRB (0.50) THRBESR1GPR84THRA
SCHEMBL28763164 0.90 THRB (0.50) THRBESR1GPR84THRA
SCHEMBL30448364 0.90 THRB (0.50) THRBESR1GPR84THRA
SCHEMBL30474595 0.90 THRB (0.50) THRBESR1GPR84THRA
SCHEMBL18469258 0.85 THRB (0.46) THRBESR1GPR84THRA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-107752159-A Green intelligent gym suit 南通蛇类治疗研究所 2018-03-06 CN disclosed
EP-1917311-B1 Rylene based multiple chromophores BASF SE (DE) 2015-09-23 EP disclosed
EP-1927141-A2 FLUORESCENT SOLAR CONVERSION CELLS BASED ON FLUORESCENT TERYLENE DYES BASF SE (DE) 2008-06-04 EP disclosed
WO-2007031446-A2 FLUORESCENT SOLAR CONVERSION CELLS BASED ON FLUORESCENT TERYLENE DYES BASF SE (DE) 2007-03-22 WO disclosed