SCHEMBL7933164

SCHEMBL7933164

CCCCC(O)CCC1[C@H](C)CCCC1(C)C

nearest known ligand 0.31

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
TBXA2R P21731 1/20 0.31
PTGFR P43088 1/20 0.31
PTGER2 P43116 1/20 0.31

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
SCHEMBL7933166 1.00 TBXA2R (0.31) TBXA2RPTGFRPTGER2
SCHEMBL4771052 0.96 PTGER2 (0.35) TBXA2RPTGFRPTGER2
SCHEMBL4777249 0.94 PTGER2 (0.37) TBXA2RPTGFRPTGER2
SCHEMBL7625294 0.94 PTGER2 (0.37) TBXA2RPTGFRPTGER2
SCHEMBL24425869 0.91
SCHEMBL21952975 0.91
SCHEMBL20591022 0.91
SCHEMBL20591035 0.91
SCHEMBL21952799 0.91
SCHEMBL4660799 0.91

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-RE37159-E1 Propanol derivatives and perfumes containing the same TAKASAGO INTERNATIONAL CORPORATION (JP) 2001-05-01 US disclosed
EP-0456932-B1 Propanol derivatives and perfumes containing the same TAKASAGO PERFUMERY CO LTD (JP) 1995-01-18 EP disclosed
US-5250512-A Diffusible, stable amber-like fragrance with high retention TAKASAGO INTERNATIONAL CORPORATION (JP) 1993-10-05 US disclosed
EP-0456932-A1 Propanol derivatives and perfumes containing the same Takasago International Corporation (JP) 1991-11-21 EP disclosed