SCHEMBL7086817

SCHEMBL7086817

CCCCCC(O)CCCCCNCCNCCCCCC(O)CCCCC

nearest known ligand 0.56

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.56
TSHR P16473 1/20 0.56
FFAR4 Q5NUL3 1/20 0.52
FFAR1 O14842 1/20 0.52
GPR84 Q9NQS5 7/20 0.48
S1PR2 O95136 5/20 0.47
S1PR4 O95977 5/20 0.47
S1PR1 P21453 5/20 0.47
S1PR3 Q99500 5/20 0.47
S1PR5 Q9H228 1/20 0.47
FAAH O00519 2/20 0.46
NFKB1 P19838 1/20 0.46
FDPS P14324 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
SCHEMBL748528 1.00 ALDH1A1 (0.56) ALDH1A1TSHRFFAR4FFAR1GPR84
SCHEMBL29894248 0.98 ALDH1A1 (0.54) ALDH1A1TSHRFFAR4FFAR1GPR84
SCHEMBL9880954 0.98 ALDH1A1 (0.59) ALDH1A1TSHRFFAR4FFAR1GPR84
SCHEMBL19066838 0.98 ALDH1A1 (0.59) ALDH1A1TSHRFFAR4FFAR1GPR84
SCHEMBL1289280 0.98 ALDH1A1 (0.59) ALDH1A1TSHRFFAR4FFAR1GPR84
SCHEMBL19066837 0.98 ALDH1A1 (0.59) ALDH1A1TSHRFFAR4FFAR1GPR84
SCHEMBL1289353 0.96 TSHR (0.56) ALDH1A1TSHRFFAR4FFAR1GPR84
Ethylene SCHEMBL11903760 0.94 ALDH1A1 (0.54) ALDH1A1TSHRFFAR4FFAR1GPR84
SCHEMBL1289261 0.94 ALDH1A1 (0.54) ALDH1A1TSHRFFAR4FFAR1GPR84
SCHEMBL1687579 0.94 ALDH1A1 (0.54) ALDH1A1TSHRFFAR4FFAR1GPR84

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-20030207114-A1 Adhesion promoters for polymer coatings on metals are articulated into at least two head groups connected by a hydrocarbon spacer group. One head group reacts particularly well with polymer molecules. Other head groups form a durable INFINEON TECHNOLONGIES AG 2003-11-06 US claimed