SCHEMBL5517612

SCHEMBL5517612

O=C(O)CCCNn1cccc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ATM Q13315 1/20 0.41
LMNA P02545 3/20 0.40
SLC22A6 Q4U2R8 1/20 0.40
CYP4Z1 Q86W10 4/20 0.39
CYP1A2 P05177 1/20 0.39
CYP2C8 P10632 1/20 0.39
CYP2B6 P20813 1/20 0.39
CYP4F8 P98187 1/20 0.39
CYP4F12 Q9HCS2 1/20 0.39
TSHR P16473 1/20 0.39
NFKB1 P19838 1/20 0.39
PMP22 Q01453 1/20 0.39
HTT P42858 1/20 0.38
PRMT1 Q99873 1/20 0.38
HDAC3 O15379 1/20 0.36
MAPK1 P28482 1/20 0.36
ADRA1A P35348 1/20 0.36
HDAC4 P56524 1/20 0.36
SLC6A3 Q01959 1/20 0.36
HDAC1 Q13547 1/20 0.36

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
SCHEMBL5521556 0.94 PRMT1 (0.45) LMNASLC22A6CYP4Z1CYP1A2CYP2C8
SCHEMBL15204254 0.87 ALDH1A1 (0.36) ATMLMNASLC22A6HTT
SCHEMBL29280307 0.68 PTGS1 (0.55) ATMLMNASLC22A6CYP4Z1CYP1A2
Adipic Acid SCHEMBL27479224 0.68 LMNA (0.85) LMNASLC22A6TSHRNFKB1PMP22
Glutarate SCHEMBL27824860 0.68 SLC22A6 (0.85) LMNASLC22A6CYP1A2TSHRNFKB1
SCHEMBL1278389 0.67 TBXAS1 (0.48) LMNASLC22A6CYP1A2TSHRNFKB1
SCHEMBL112741 0.66 LMNA (0.59) LMNASLC22A6CYP1A2TSHRNFKB1
Glutarate SCHEMBL27634315 0.66 SLC22A6 (0.79) LMNASLC22A6CYP1A2TSHRNFKB1
Adipic Acid SCHEMBL28248018 0.66 LMNA (0.79) LMNASLC22A6TSHRNFKB1PMP22
Sebacic Acid SCHEMBL27937400 0.66 TSHR (0.86) LMNASLC22A6TSHRNFKB1PMP22

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