SCHEMBL27932829

SCHEMBL27932829

CC=CCC(C(=O)O)C(C)C(=O)OCCCCCCCC

nearest known ligand 0.44

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
HCAR2 Q8TDS4 2/20 0.42
NAAA Q02083 1/20 0.40
EPHX2 P34913 2/20 0.39
EPHX1 P07099 1/20 0.38
NOD1 Q9Y239 1/20 0.38
TSHR P16473 2/20 0.37
HTR2C P28335 1/20 0.37

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
SCHEMBL27737017 0.94 ATM (0.40) HCAR2EPHX2TSHR
SCHEMBL27932827 0.91 NAAA (0.42) HCAR2NAAAEPHX2EPHX1TSHR
SCHEMBL27737145 0.88 HCAR2 (0.36) HCAR2
SCHEMBL27736971 0.85 ATM (0.42) HCAR2NAAATSHR
SCHEMBL27737016 0.82 ATM (0.40) HCAR2EPHX2TSHR
SCHEMBL8482708 0.82 GRIK1 (0.36) TSHR
SCHEMBL27737032 0.81 ATM (0.39) HCAR2NAAATSHR
SCHEMBL27783547 0.80 NAAA (0.46) HCAR2NAAAEPHX1NOD1TSHR
SCHEMBL375695 0.78 GRIK1 (0.40)
SCHEMBL27736981 0.77 TSHR (0.38) TSHR

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
CN-102822208-B Preparation method of solid catalyst for propylene polymerization, and catalyst prepared thereby SAMSUNG TOTAL PETROCHEMICALS 2014-09-24 CN disclosed
CN-103509142-A Solid catalyst for propylene polymerization and a method for preparation of polypropylene SAMSUNG TOTAL PETROCHEMICALS 2014-01-15 CN disclosed