SCHEMBL5513749

SCHEMBL5513749

O=C(O)CCCCC(CNc1ccccc1)C(=O)O

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGER1 P34995 1/20 0.49
PTGFR P43088 1/20 0.49
CPA3 P15088 1/20 0.45
FFAR1 O14842 1/20 0.43
ALDH1A1 P00352 1/20 0.42
CYP1A2 P05177 1/20 0.42
CYP2D6 P10635 1/20 0.42
TSHR P16473 1/20 0.42
CYP2C19 P33261 1/20 0.42
HDAC8 Q9BY41 6/20 0.42
HDAC3 O15379 4/20 0.42
HDAC6 Q9UBN7 4/20 0.42
HDAC1 Q13547 3/20 0.42
HDAC2 Q92769 2/20 0.42
HDAC4 P56524 1/20 0.42
HDAC7 Q8WUI4 1/20 0.42
HDAC10 Q969S8 1/20 0.42
HDAC11 Q96DB2 1/20 0.42
HDAC9 Q9UKV0 1/20 0.42
HDAC5 Q9UQL6 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
SCHEMBL5508265 0.89 CPA3 (0.57) PTGER1PTGFRCPA3FFAR1ALDH1A1
SCHEMBL10765112 0.83 MAPK1 (0.57) ALDH1A1TSHRHDAC8HDAC3HDAC6
SCHEMBL4026828 0.79 MAPT (0.40) CPA3CYP1A2TSHRGAA
SCHEMBL5523832 0.78 CPA1 (0.55) CPA3FFAR1ALDH1A1CYP1A2TSHR
SCHEMBL26679347 0.76 CPA3 (0.77) CPA3CYP1A2FOLH1
SCHEMBL18857497 0.75 BCHE (0.49) CPA3HDAC8HDAC3HDAC6HDAC1
SCHEMBL11019050 0.75 MEN1 (0.56) ALDH1A1CYP1A2TSHRGAA
SCHEMBL6130488 0.74 MAPT (0.61) FFAR1ALDH1A1HDAC8HDAC3HDAC6
SCHEMBL31303730 0.74 CPA3 (0.75) CPA3CYP1A2HDAC8HDAC3HDAC6
SCHEMBL11143841 0.74 CPA3 (0.75) CPA3CYP1A2HDAC8HDAC3HDAC6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1470258-B1 COMPOSITION AND ITS USE FOR IMPARTING WATER REPELLENCY TO LEATHER OR FURSKINS, TEXTILES AND OTHER FIBROUS MATERIALS TFL LEDERTECHNIK GMBH (DE) 2013-08-28 EP disclosed
US-7250456-B2 Composition and its use for imparting water repellency to leather or furskins, textiles and other fibrous materials TFL LEDERTECHNIK GMBH (DE) 2007-07-31 US disclosed
US-20050148702-A1 Composition and its use for imparting water repellency to leather or furskins, textiles and other fibrous materials TFL LEDERTECHNIK GMBH (DE) 2005-07-07 US disclosed
EP-1470258-A1 COMPOSITION AND ITS USE FOR IMPARTING WATER REPELLENCY TO LEATHER OR FURSKINS, TEXTILES AND OTHER FIBROUS MATERIALS TFL Ledertechnik GmbH (DE) 2004-10-27 EP disclosed
WO-2003064707-A1 COMPOSITIONS AND ITS USE FOR IMPARTING WATER REPELLENCY TO LEATHER OR FURSKINS, TEXTILES AND OTHER FIBROUS MATERIALS TFL LEDERTECHNIK GMBH (DE) 2003-08-07 WO disclosed