SCHEMBL31662687

SCHEMBL31662687

c1ccc(COC2CC(OC3CCOCC3)C2)cc1

nearest known ligand 0.45

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CTSL P07711 1/20 0.42
CTSB P07858 1/20 0.42
CTSK P43235 1/20 0.42
OPRM1 P35372 2/20 0.41
OPRL1 P41146 2/20 0.41
DPP4 P27487 1/20 0.41
NAAA Q02083 3/20 0.40
SIGMAR1 Q99720 2/20 0.40
TMEM97 Q5BJF2 1/20 0.40
CARM1 Q86X55 1/20 0.40
PRMT6 Q96LA8 1/20 0.40
PRMT8 Q9NR22 1/20 0.40
HRH3 Q9Y5N1 1/20 0.40
AGTR2 P50052 2/20 0.36
EPHX2 P34913 1/20 0.36
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
DCPS Q96C86 1/20 0.36

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
SCHEMBL29284943 0.89 CTSL (0.47) CTSLCTSBCTSKOPRM1OPRL1
SCHEMBL31248144 0.87 OPRM1 (0.51) CTSLCTSBCTSKOPRM1OPRL1
SCHEMBL21028919 0.84 CTSL (0.47) CTSLCTSBCTSKOPRM1OPRL1
SCHEMBL29079652 0.81 SLC6A2 (0.52) CTSLCTSBCTSKOPRM1OPRL1
SCHEMBL21673506 0.81 SLC6A2 (0.52) CTSLCTSBCTSKOPRM1OPRL1
SCHEMBL28179070 0.81 OPRM1 (0.47) CTSLCTSBCTSKOPRM1OPRL1
SCHEMBL28072324 0.80 CTSL (0.46) CTSLCTSBCTSKOPRM1OPRL1
SCHEMBL11244939 0.80 CTSL (0.46) CTSLCTSBCTSKOPRM1OPRL1
SCHEMBL22901710 0.76 CTSL (0.49) CTSLCTSBCTSKOPRM1OPRL1
SCHEMBL1560105 0.76 CTSL (0.43) CTSLCTSBCTSKOPRM1OPRL1

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-2025149545-A1 HETEROARYLPHENYL ETHER DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2025-07-17 WO disclosed