SCHEMBL28640857

SCHEMBL28640857

CC1CCC(C)(CC2CCCCC2)C(C)C1

nearest known ligand 0.32

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ACHE P22303 1/20 0.32
SIGMAR1 Q99720 2/20 0.32

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
SCHEMBL31154595 0.72 ACHE (0.41) ACHESIGMAR1
SCHEMBL4814952 0.65 CYP1A2 (0.36) ACHESIGMAR1
SCHEMBL31154616 0.64 CYP1A2 (0.37) ACHE
SCHEMBL14028053 0.64 ACHE (0.37) ACHE
SCHEMBL24685640 0.64
SCHEMBL1221805 0.64 OPRM1 (0.34) SIGMAR1
SCHEMBL21115811 0.62 OPRM1 (0.33) SIGMAR1
SCHEMBL11430167 0.62 OPRM1 (0.33) SIGMAR1
SCHEMBL17807901 0.62 ACHE (0.34) ACHESIGMAR1
SCHEMBL1333428 0.62

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
CN-111434670-B Fluorine-containing compound and application thereof, ethylene oligomerization catalyst composition, ethylene oligomerization method, ethylene trimerization method and ethylene tetramerization method 中国石油化工股份有限公司 2021-07-30 CN disclosed