SCHEMBL29010087

SCHEMBL29010087

O=C(O)CCCc1ccc(CC(F)F)cc1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.60
HDAC3 O15379 1/20 0.60
MAPK1 P28482 1/20 0.60
ADRA1A P35348 1/20 0.60
HDAC4 P56524 1/20 0.60
SLC6A3 Q01959 1/20 0.60
HDAC1 Q13547 1/20 0.60
HDAC7 Q8WUI4 1/20 0.60
HDAC2 Q92769 1/20 0.60
HDAC10 Q969S8 1/20 0.60
HDAC11 Q96DB2 1/20 0.60
HDAC8 Q9BY41 1/20 0.60
HDAC6 Q9UBN7 1/20 0.60
HDAC9 Q9UKV0 1/20 0.60
HDAC5 Q9UQL6 1/20 0.60
HSD17B10 Q99714 1/20 0.56
FFAR1 O14842 7/20 0.53
MAPT P10636 2/20 0.52
RXFP1 Q9HBX9 1/20 0.52
RXRA P19793 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
SCHEMBL29009753 0.85 SMN1; SMN2 (0.60) SMN1; SMN2HDAC3MAPK1ADRA1AHDAC4
SCHEMBL6208836 0.84 SMN1; SMN2 (0.82) SMN1; SMN2HDAC3MAPK1ADRA1AHDAC4
SCHEMBL29010112 0.83 SMN1; SMN2 (0.58) SMN1; SMN2HDAC3MAPK1ADRA1AHDAC4
SCHEMBL30428172 0.83 SMN1; SMN2 (0.58) SMN1; SMN2HDAC3MAPK1ADRA1AHDAC4
SCHEMBL69789 0.82 SMN1; SMN2 (0.78) SMN1; SMN2HDAC3MAPK1ADRA1AHDAC4
SCHEMBL29009794 0.81 SMN1; SMN2 (0.60) SMN1; SMN2HDAC3MAPK1ADRA1AHDAC4
SCHEMBL765464 0.81 HSD17B10 (0.61) SMN1; SMN2HDAC3MAPK1ADRA1AHDAC4
SCHEMBL29010012 0.79 SMN1; SMN2 (0.56) SMN1; SMN2HDAC3MAPK1ADRA1AHDAC4
SCHEMBL29009977 0.79 HSD17B10 (0.57) SMN1; SMN2HDAC3MAPK1ADRA1AHDAC4
SCHEMBL7814870 0.79 SMN1; SMN2 (0.67) 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