SCHEMBL22368446

SCHEMBL22368446

C=CCCCCCCCC(C)(C)OCCC(C)(C)O

nearest known ligand 0.36

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.36
ALDH1A1 P00352 3/20 0.36
LPAR3 Q9UBY5 2/20 0.36
LMNA P02545 1/20 0.36
LPAR2 Q9HBW0 1/20 0.36
ABCC4 O15439 1/20 0.32
MAPT P10636 1/20 0.32
ACLY P53396 1/20 0.30

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
SCHEMBL14088846 1.00 TSHR (0.36) TSHRALDH1A1LPAR3LMNALPAR2
SCHEMBL14517198 0.84 TSHR (0.38) TSHRALDH1A1LPAR3LMNALPAR2
SCHEMBL3119340 0.82 TSHR (0.48) TSHRALDH1A1LPAR3LMNALPAR2
SCHEMBL7606780 0.81 TSHR (0.48) TSHRALDH1A1LPAR3LMNALPAR2
SCHEMBL11697159 0.81 TSHR (0.48) TSHRALDH1A1LPAR3LMNALPAR2
SCHEMBL17520315 0.81 TSHR (0.48) TSHRALDH1A1LPAR3LMNALPAR2
SCHEMBL3121245 0.81 TSHR (0.48) TSHRALDH1A1LPAR3LMNALPAR2
SCHEMBL18480166 0.81 TSHR (0.48) TSHRALDH1A1LPAR3LMNALPAR2
SCHEMBL22997307 0.80 LPAR3 (0.41) LPAR3LMNALPAR2MAPTACLY
SCHEMBL19139122 0.80 LPAR2 (0.41) TSHRALDH1A1LPAR3LMNALPAR2

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
EP-2841468-B1 UNSATURATED FATTY ALCOHOL ALKOXYLATES FROM NATURAL OIL METATHESIS STEPAN CO (US) 2020-08-26 EP disclosed