SCHEMBL9861570

SCHEMBL9861570

O=C(O)CCCCCCc1ccccc1C(=O)O

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.59
RXFP1 Q9HBX9 1/20 0.59
FOLH1 Q04609 1/20 0.58
F13A1 P00488 3/20 0.55
SLC16A3 O15427 7/20 0.54
HDAC3 O15379 1/20 0.50
HDAC4 P56524 1/20 0.50
HDAC1 Q13547 1/20 0.50
HDAC7 Q8WUI4 1/20 0.50
HDAC2 Q92769 1/20 0.50
HDAC10 Q969S8 1/20 0.50
HDAC11 Q96DB2 1/20 0.50
HDAC8 Q9BY41 1/20 0.50
HDAC6 Q9UBN7 1/20 0.50
HDAC9 Q9UKV0 1/20 0.50
HDAC5 Q9UQL6 1/20 0.50
LTB4R Q15722 4/20 0.49
LTB4R2 Q9NPC1 1/20 0.49
CYSLTR2 Q9NS75 1/20 0.49
CYSLTR1 Q9Y271 1/20 0.49

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
SCHEMBL503904 1.00 MAPT (0.59) MAPTRXFP1FOLH1F13A1SLC16A3
SCHEMBL30637100 0.93 FOLH1 (0.61) MAPTRXFP1FOLH1SLC16A3HDAC3
SCHEMBL9759595 0.93 FOLH1 (0.61) MAPTRXFP1FOLH1SLC16A3HDAC3
SCHEMBL9345842 0.91 FOLH1 (0.68) FOLH1SLC16A3
SCHEMBL729909 0.89 FOLH1 (0.70) FOLH1SLC16A3
SCHEMBL29062 0.85 FOLH1 (0.66) FOLH1SLC16A3HDAC3HDAC4HDAC1
SCHEMBL6271561 0.85 BID (0.51) MAPTRXFP1FOLH1F13A1SLC16A3
SCHEMBL10659962 0.85 BID (0.51) MAPTRXFP1FOLH1F13A1SLC16A3
SCHEMBL11099396 0.85 MAPT (0.54) MAPTRXFP1F13A1HDAC3HDAC4
SCHEMBL692509 0.85 F13A1 (0.50) MAPTRXFP1F13A1SLC16A3HDAC3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5006205-A Water-formic acid azeotrope broken by extractor Berg, Lloyd (US) 1991-04-09 US disclosed