SCHEMBL8528549

SCHEMBL8528549

[CH2]CCCCOC(=O)OC(=CC(=O)O)C(=O)O

nearest known ligand 0.32

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.32
CYP3A4 P08684 1/20 0.32
TSHR P16473 1/20 0.32
HCAR2 Q8TDS4 2/20 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
SCHEMBL8618537 0.72 HCAR2 (0.40) ALDH1A1CYP3A4TSHRHCAR2
SCHEMBL23093044 0.71 TSHR (0.46) ALDH1A1CYP3A4TSHRHCAR2
SCHEMBL1559345 0.66 ALDH1A1 (0.38) ALDH1A1CYP3A4TSHR
SCHEMBL5071801 0.66 HCAR2 (0.53) ALDH1A1TSHRHCAR2
SCHEMBL9715428 0.65 TSHR (0.40) ALDH1A1CYP3A4TSHR
SCHEMBL3118931 0.65 ALDH1A1 (0.56) ALDH1A1CYP3A4TSHR
SCHEMBL9839017 0.65 ALDH1A1 (0.52) ALDH1A1CYP3A4TSHRHCAR2
SCHEMBL4312979 0.65 TSHR (0.40) ALDH1A1CYP3A4TSHR
SCHEMBL7483442 0.64 KDM4E (0.39) TSHR
SCHEMBL1557571 0.63 ALDH1A1 (0.54) ALDH1A1CYP3A4TSHRHCAR2

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
EP-0745900-B1 Water-developing photosensitive resin composition NIPPON PAINT CO LTD (JP) 1998-12-30 EP disclosed
EP-0745900-A1 Water-developing photosensitive resin composition Nippon Paint Co., Ltd. (JP) 1996-12-04 EP disclosed