SCHEMBL3829472

SCHEMBL3829472

CCCCCCCC/C=C\CCCCCCCCC(CCO)[N+](C)(C)C(CCO)(C(=O)[O-])C(=O)O

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FABP3 P05413 6/20 0.39
FFAR1 O14842 1/20 0.38
FFAR4 Q5NUL3 1/20 0.38
TERT O14746 3/20 0.37
PTPN1 P18031 3/20 0.37
PPARG P37231 3/20 0.37
PPARD Q03181 3/20 0.37
PPARA Q07869 3/20 0.37
MAPT P10636 2/20 0.37
BLM P54132 2/20 0.37
HSD17B10 Q99714 2/20 0.37
FABP4 P15090 2/20 0.37
TOP1 P11387 2/20 0.37
GMNN O75496 1/20 0.37
USP2 O75604 1/20 0.37
LMNA P02545 1/20 0.37
CYP1A2 P05177 1/20 0.37
POLB P06746 1/20 0.37
CYP2C9 P11712 1/20 0.37
ALOX15 P16050 1/20 0.37

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
SCHEMBL127826 0.74 HSPD1 (0.37) FFAR1FFAR4BLMMMP2
SCHEMBL4464049 0.67 PPARG (0.46) FABP3FFAR1FFAR4TERTPTPN1
SCHEMBL17451095 0.66 TERT (0.51) FFAR1FFAR4TERTPTPN1PPARG
SCHEMBL17451097 0.66 TERT (0.51) FFAR1FFAR4TERTPTPN1PPARG
SCHEMBL1589440 0.66 FABP3 (0.58) FABP3TERTPTPN1PPARGPPARD
SCHEMBL8582287 0.65 FABP3 (0.54) FABP3TERTMAPTBLMHSD17B10
SCHEMBL18954252 0.65 TERT (0.58) TERTPTPN1PPARGPPARDPPARA
SCHEMBL4837509 0.65 FABP3 (0.53) FABP3TERTPTPN1PPARGPPARD
SCHEMBL83946 0.65 FABP3 (0.53) FABP3TERTPTPN1PPARGPPARD
SCHEMBL16817948 0.65 FAAH (0.48) FFAR1FFAR4TERTPTPN1PPARG

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
US-20090057618-A1 Corrosion inhibitors containing amphoteric surfactants CLARIANT INTERNATIONAL LTD. 2009-03-05 US disclosed
EP-2031092-A2 Corrosion inhibitors containing amphoteric tensides Clariant International Ltd. (CH) 2009-03-04 EP disclosed