SCHEMBL9862102

SCHEMBL9862102

CCOC(=O)OOCCOC(=O)C=COOC(C)(C)CC

nearest known ligand 0.32

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
HCAR2 Q8TDS4 2/20 0.32
ATM Q13315 1/20 0.32
ALDH1A1 P00352 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
SCHEMBL10498335 0.89 HCAR2 (0.33) HCAR2ATMALDH1A1
SCHEMBL2774385 0.82 HCAR2 (0.40) HCAR2ATM
SCHEMBL9862015 0.80 HCAR2 (0.35) HCAR2ALDH1A1
SCHEMBL9862022 0.77 LMNA (0.34)
SCHEMBL5597025 0.73 ALDH1A1 (0.38) HCAR2ALDH1A1
SCHEMBL7683853 0.72 HCAR2 (0.32) HCAR2ATM
SCHEMBL2768951 0.71 HCAR2 (0.41) HCAR2ATM
SCHEMBL7691585 0.69 HCAR2 (0.35) HCAR2ATM
SCHEMBL9249708 0.69 HCAR2 (0.31) HCAR2
SCHEMBL28453569 0.68 ALDH1A1 (0.46) ALDH1A1

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-0423767-A2 Thermoplastic resin composition and method for preparing the same NIPPON PETROCHEMICALS COMPANY, LIMITED (JP) 1991-04-24 EP disclosed