SCHEMBL8522278

SCHEMBL8522278

C/C=C/C(=O)Oc1ccc(CCCCCCC)cc1

nearest known ligand 0.68

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
THRB P10828 7/20 0.68
THRA P10827 5/20 0.64
ATG4B Q9Y4P1 11/20 0.51
PLA2G1B P04054 9/20 0.51
CYP1A2 P05177 1/20 0.51
TDP1 Q9NUW8 1/20 0.51
RECQL P46063 1/20 0.51
MEN1 O00255 1/20 0.50
KMT2A Q03164 1/20 0.50

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
SCHEMBL5297320 1.00 THRB (0.68) THRBTHRAATG4BPLA2G1BCYP1A2
SCHEMBL9773374 0.92 THRB (0.74) THRBTHRAATG4BPLA2G1BCYP1A2
SCHEMBL11037915 0.92 THRB (0.74) THRBTHRAATG4BPLA2G1BCYP1A2
SCHEMBL4544929 0.92 THRB (0.74) THRBTHRAATG4BPLA2G1BCYP1A2
SCHEMBL12536627 0.92 THRB (0.74) THRBTHRAATG4BPLA2G1BCYP1A2
SCHEMBL27974331 0.89 THRB (0.55) THRBTHRAMEN1KMT2A
SCHEMBL20512328 0.87 THRB (0.68) THRBTHRAATG4BPLA2G1BKMT2A
SCHEMBL25573713 0.87 THRB (0.67) THRBTHRAATG4BPLA2G1BCYP1A2
SCHEMBL10709445 0.87 THRB (0.67) THRBTHRAATG4BPLA2G1BCYP1A2
SCHEMBL28233980 0.85 THRB (0.65) THRBTHRAATG4BPLA2G1BCYP1A2

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
EP-0942651-A1 INSECTICIDAL AND MITICIDAL COMPOSITIONS AMERICAN CYANAMID COMPANY (US) 1999-09-22 EP claimed
WO-1998023154-A1 INSECTICIDAL AND MITICIDAL COMPOSITIONS AMERICAN CYANAMID COMPANY (US) 1998-06-04 WO claimed