SCHEMBL23705135

SCHEMBL23705135

c1ccc(COCC2(OCc3ccccc3)OCCCC2OCc2ccccc2)cc1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.35
TACR1 P25103 1/20 0.35
OPRM1 P35372 2/20 0.33
OPRL1 P41146 2/20 0.33
CTSV O60911 1/20 0.33
CTSL P07711 1/20 0.33
CTSB P07858 1/20 0.33
CTSS P25774 1/20 0.33
CTSK P43235 1/20 0.33
CTSC P53634 1/20 0.33
CTSF Q9UBX1 1/20 0.33
DPP4 P27487 1/20 0.33
BCHE P06276 1/20 0.33
ACHE P22303 1/20 0.33
PSEN1 P49768 1/20 0.32
PSEN2 P49810 1/20 0.32
APH1B Q8WW43 1/20 0.32
NCSTN Q92542 1/20 0.32
APH1A Q96BI3 1/20 0.32
PSENEN Q9NZ42 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
SCHEMBL28900622 0.83 TSHR (0.36) TSHRTACR1
SCHEMBL23705222 0.74 OPRM1 (0.36) TSHRTACR1OPRM1OPRL1CTSL
SCHEMBL24736773 0.74 LMNA (0.36) TSHRTACR1CTSVCTSLCTSB
SCHEMBL8067905 0.72 BCHE (0.46) TSHRTACR1CTSVCTSLCTSB
SCHEMBL18616170 0.70 OPRM1 (0.40) TACR1OPRM1OPRL1CTSVCTSL
SCHEMBL714091 0.70 TSHR (0.48) TSHRTACR1
SCHEMBL28331193 0.69 TACR1 (0.40) TSHRTACR1OPRM1OPRL1DPP4
SCHEMBL30590043 0.69 CTSL (0.39) TSHRTACR1OPRM1OPRL1CTSV
SCHEMBL28991864 0.69 CYP2C19 (0.34) TSHRTACR1CTSVCTSLCTSB
SCHEMBL28845249 0.69 TACR1 (0.41) TSHRTACR1OPRM1OPRL1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4097138-A1 ASGPR-BINDING COMPOUNDS FOR THE DEGRADATION OF EXTRACELLULAR PROTEINS Avila Therapeutics, Inc. (US) 2022-12-07 EP disclosed
WO-2021155317-A1 ASGPR-BINDING COMPOUNDS FOR THE DEGRADATION OF EXTRACELLULAR PROTEINS AVILAR THERAPEUTICS, INC. (US) 2021-08-05 WO disclosed