SCHEMBL30737871

SCHEMBL30737871

CC1(C)OCC([C@@H](CN=[N+]=[N-])OCc2ccccc2)O1

nearest known ligand 0.35

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ TMEM97 Q5BJF2 2/20 0.33
▸ SIGMAR1 Q99720 2/20 0.33
▸ POLB P06746 1/20 0.32
▸ MAPT P10636 1/20 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
SCHEMBL23162022 1.00 TMEM97 (0.33) TMEM97SIGMAR1POLBMAPT
SCHEMBL23162023 1.00 TMEM97 (0.33) TMEM97SIGMAR1POLBMAPT
SCHEMBL13841807 0.80 TMEM97 (0.36) TMEM97SIGMAR1POLBMAPT
SCHEMBL8842389 0.78 TMEM97 (0.34) TMEM97SIGMAR1MAPT
SCHEMBL8842356 0.78 TMEM97 (0.34) TMEM97SIGMAR1MAPT
SCHEMBL8842354 0.78 TMEM97 (0.34) TMEM97SIGMAR1MAPT
SCHEMBL7157297 0.78 TMEM97 (0.39) TMEM97SIGMAR1MAPT
SCHEMBL11961360 0.76 TMEM97 (0.38) TMEM97SIGMAR1MAPT
SCHEMBL11961357 0.76 TMEM97 (0.38) TMEM97SIGMAR1MAPT
SCHEMBL1487127 0.76 TMEM97 (0.38) TMEM97SIGMAR1MAPT

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
US-20240036042-A1 CLICK CHEMISTRY AMPLIFIED NANOPORE ASSAY FOR ULTRASENSITIVE QUANTIFICATION OF PROTEINS NATIONAL SCIENCE FOUNDATION 2024-02-01 — — US disclosed
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