SCHEMBL25637699

SCHEMBL25637699

CC(C)OCC(C)OCC#Cc1ccc(OC2CC(OC(C)C)C2)cn1

nearest known ligand 0.31

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
GRM5 P41594 2/20 0.31
ACACB O00763 1/20 0.31
ACACA Q13085 1/20 0.31
GRIN1 Q05586 1/20 0.31
GRIN2B Q13224 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
SCHEMBL26381566 0.93 GRM5 (0.33) GRM5ACACBACACAGRIN1GRIN2B
SCHEMBL20233664 0.92 GRM5 (0.33) GRM5ACACBACACAGRIN1GRIN2B
SCHEMBL20230919 0.84 GRM5 (0.34) GRM5ACACBGRIN1GRIN2B
SCHEMBL26972411 0.84 ACACB (0.30) ACACBACACAGRIN1GRIN2B
SCHEMBL21026184 0.83
SCHEMBL26972412 0.83 GRM5 (0.32) GRM5ACACBACACA
SCHEMBL27097450 0.81 GRM5 (0.34) GRM5ACACB
SCHEMBL27097546 0.81 GRM5 (0.34) GRM5ACACB
SCHEMBL20128784 0.81 GRIN1 (0.30) GRIN1GRIN2B
SCHEMBL26972410 0.78 GRIN1 (0.31) ACACBACACAGRIN1GRIN2B

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
WO-2023097251-A1 OLIGONUCLEOTIDE-CONTAINING TRANSCRIPTION FACTOR TARGETING CHIMERAS YALE UNIVERSITY (US) 2023-06-01 WO disclosed