SCHEMBL9739314

SCHEMBL9739314

CCCCOOC(OOCCCC)C(C)(OOCCCC)OC(=O)O

nearest known ligand 0.32

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
HPGD P15428 1/20 0.32
TSHR P16473 1/20 0.32
ALDH1A1 P00352 1/20 0.32
HCAR2 Q8TDS4 1/20 0.30
ATM Q13315 1/20 0.30
CA2 P00918 1/20 0.30
MAPK1 P28482 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
SCHEMBL131237 0.76 ALDH1A1 (0.38) HPGDTSHRALDH1A1HCAR2ATM
SCHEMBL27136179 0.76 ALDH1A1 (0.34) HPGDTSHRALDH1A1HCAR2ATM
SCHEMBL7683820 0.75 ALDH1A1 (0.30) ALDH1A1
SCHEMBL28193410 0.73 TSHR (0.38) HPGDTSHRALDH1A1HCAR2ATM
SCHEMBL28007875 0.72 ALDH1A1 (0.34) HPGDTSHRALDH1A1HCAR2ATM
SCHEMBL28161237 0.72 ALDH1A1 (0.34) HPGDTSHRALDH1A1HCAR2ATM
SCHEMBL5611403 0.72 CA2 (0.40) HPGDTSHRALDH1A1HCAR2ATM
SCHEMBL28708557 0.72
SCHEMBL8593909 0.71 NAAA (0.37) TSHRALDH1A1HCAR2MAPK1
SCHEMBL28161238 0.71 HCAR2 (0.35) HPGDTSHRALDH1A1HCAR2ATM

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-5098973-A Waterproofing composition for flooring in food processing plants, refrigeration warehouse and cold storage SUMITOMO RUBBER INDUSTRIES LTD. (JP) 1992-03-24 US disclosed