SCHEMBL22906877

SCHEMBL22906877

C=C(C)C(/C=C/C)(COCCCO)COC1CC(OCc2ccccc2)C1

nearest known ligand 0.35

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ OPRM1 P35372 2/20 0.34
▸ OPRL1 P41146 2/20 0.34
▸ BCHE P06276 2/20 0.32
▸ TEAD3 Q99594 1/20 0.31
▸ TMEM97 Q5BJF2 1/20 0.31
▸ CARM1 Q86X55 1/20 0.31
▸ PRMT6 Q96LA8 1/20 0.31
▸ SIGMAR1 Q99720 1/20 0.31
▸ PRMT8 Q9NR22 1/20 0.31
▸ HRH3 Q9Y5N1 1/20 0.31
▸ CHRM3 P20309 1/20 0.31
▸ PDE4D Q08499 1/20 0.30
▸ DPP4 P27487 1/20 0.30
▸ CTSL P07711 1/20 0.30
▸ CTSB P07858 1/20 0.30
▸ CTSK P43235 1/20 0.30

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
SCHEMBL22906876 0.86 OPRM1 (0.33) OPRM1OPRL1BCHETMEM97CARM1
SCHEMBL27133585 0.77 LIPG (0.37) OPRM1OPRL1BCHEPDE4DDPP4
SCHEMBL22906875 0.75 BCHE (0.36) OPRM1OPRL1BCHETMEM97CARM1
SCHEMBL20120320 0.73 CTSL (0.44) OPRM1OPRL1BCHETMEM97CARM1
SCHEMBL20120322 0.73 CTSL (0.44) OPRM1OPRL1BCHETMEM97CARM1
SCHEMBL23205312 0.68 CTSL (0.46) OPRM1OPRL1BCHETMEM97CARM1
SCHEMBL21421849 0.68 CTSL (0.46) OPRM1OPRL1BCHETMEM97CARM1
SCHEMBL27133574 0.64 CTSL (0.36) OPRM1OPRL1BCHETMEM97CARM1
SCHEMBL16248689 0.64 KDM4E (0.53) OPRM1HRH3CHRM3
SCHEMBL20121045 0.64 CTSL (0.45) OPRM1OPRL1BCHETMEM97CARM1

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-2021011913-A1 TAU-PROTEIN TARGETING COMPOUNDS AND ASSOCIATED METHODS OF USE ARVINAS OPERATIONS, INC. (US) 2021-01-21 — — WO disclosed
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