SCHEMBL28458976

SCHEMBL28458976

[CH2]CN(Cc1ccccc1)CC1CCCCN1

nearest known ligand 0.56

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ POLB P06746 1/20 0.56
▸ LTA4H P09960 8/20 0.46
▸ GHSR Q92847 6/20 0.45
▸ KMT2A Q03164 1/20 0.41

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
SCHEMBL22288105 0.96 POLB (0.50) POLBLTA4HGHSR
SCHEMBL21216250 0.83 POLB (0.54) POLBLTA4HGHSRKMT2A
SCHEMBL22288111 0.81 POLB (0.51) POLBLTA4HGHSRKMT2A
SCHEMBL11419707 0.81 GHSR (0.53) POLBLTA4HGHSR
SCHEMBL13220243 0.79 POLB (0.59) POLBLTA4HGHSRKMT2A
SCHEMBL28466706 0.79 CYP2D6 (0.41) POLBLTA4HGHSRKMT2A
SCHEMBL13061032 0.79 GHSR (0.48) POLBLTA4HGHSR
SCHEMBL13220245 0.75 GHSR (0.53) POLBLTA4HGHSR
SCHEMBL1355696 0.75 OPRM1 (0.59) POLBLTA4HGHSR
SCHEMBL13005704 0.73 GHSR (0.49) POLBGHSR

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-111770928-A Synthesis of oligonucleotides and nucleic acids 埃万奈蒂克有限公司 2020-10-13 — — CN disclosed
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