SCHEMBL29009771

SCHEMBL29009771

CC(F)Cc1ccccc1CCCC(=O)O

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.49
HDAC3 O15379 1/20 0.49
MAPK1 P28482 1/20 0.49
ADRA1A P35348 1/20 0.49
HDAC4 P56524 1/20 0.49
SLC6A3 Q01959 1/20 0.49
HDAC1 Q13547 1/20 0.49
HDAC7 Q8WUI4 1/20 0.49
HDAC2 Q92769 1/20 0.49
HDAC10 Q969S8 1/20 0.49
HDAC11 Q96DB2 1/20 0.49
HDAC8 Q9BY41 1/20 0.49
HDAC6 Q9UBN7 1/20 0.49
HDAC9 Q9UKV0 1/20 0.49
HDAC5 Q9UQL6 1/20 0.49
CYSLTR2 Q9NS75 6/20 0.46
CYSLTR1 Q9Y271 6/20 0.46
MAPT P10636 1/20 0.42
RXFP1 Q9HBX9 1/20 0.42
MEN1 O00255 1/20 0.42

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
SCHEMBL10203389 0.87 HDAC3 (0.52) SMN1; SMN2HDAC3MAPK1ADRA1AHDAC4
SCHEMBL31512109 0.82 HDAC3 (0.68) SMN1; SMN2HDAC3MAPK1ADRA1AHDAC4
SCHEMBL2878880 0.82 HDAC3 (0.68) SMN1; SMN2HDAC3MAPK1ADRA1AHDAC4
SCHEMBL10203390 0.81 MAPT (0.54) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL879179 0.79 HDAC3 (0.59) SMN1; SMN2HDAC3MAPK1ADRA1AHDAC4
SCHEMBL9099482 0.78 ESR1 (0.55) SMN1; SMN2HDAC3MAPK1ADRA1AHDAC4
SCHEMBL17447915 0.78 HDAC3 (0.57) SMN1; SMN2HDAC3MAPK1ADRA1AHDAC4
SCHEMBL29010000 0.78 HDAC3 (0.57) SMN1; SMN2HDAC3MAPK1ADRA1AHDAC4
SCHEMBL13491998 0.77 CYSLTR2 (0.52) CYSLTR2CYSLTR1MAPTRXFP1LTB4R
SCHEMBL14441154 0.77 CYSLTR2 (0.58) SMN1; SMN2HDAC3MAPK1ADRA1AHDAC4

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
CN-116209433-B Small molecule albumin binding agents 俄勒冈健康科学大学 2025-05-23 CN disclosed
CN-116209433-A Small molecule albumin binding agents 俄勒冈健康科学大学 2023-06-02 CN disclosed