SCHEMBL7921733

SCHEMBL7921733

c1ccc(CO[C@@H]2[C@H]3OC4(CCCCC4)O[C@H]3[C@@H](OCc3ccccc3)[C@@H]3OC4(CCCCC4)O[C@@H]23)cc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
OPRM1 P35372 2/20 0.41
OPRL1 P41146 2/20 0.41
POLB P06746 1/20 0.41
GAA P10253 1/20 0.41
MAPK1 P28482 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
PDPK1 O15530 1/20 0.40
MTOR P42345 1/20 0.40
SIGMAR1 Q99720 2/20 0.39
TMEM97 Q5BJF2 1/20 0.39
CTSL P07711 1/20 0.39
CTSB P07858 1/20 0.39
CTSK P43235 1/20 0.39
DPP4 P27487 1/20 0.38
BCHE P06276 1/20 0.38
ACHE P22303 1/20 0.38
HTR1A P08908 2/20 0.37
PSEN1 P49768 1/20 0.36
PSEN2 P49810 1/20 0.36
APH1B Q8WW43 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
SCHEMBL25627219 1.00 OPRM1 (0.41) OPRM1OPRL1POLBGAAMAPK1
SCHEMBL14094702 0.95 PDPK1 (0.42) OPRM1OPRL1POLBGAAMAPK1
SCHEMBL21510528 0.95 PDPK1 (0.42) OPRM1OPRL1POLBGAAMAPK1
SCHEMBL990387 0.95 PDPK1 (0.42) OPRM1OPRL1POLBGAAMAPK1
SCHEMBL6373575 0.93 POLB (0.40) OPRM1OPRL1POLBGAAMAPK1
SCHEMBL7911469 0.93 POLB (0.40) OPRM1OPRL1POLBGAAMAPK1
SCHEMBL7922102 0.91 POLB (0.40) OPRM1OPRL1POLBGAAMAPK1
SCHEMBL12221533 0.91 POLB (0.40) OPRM1OPRL1POLBGAAMAPK1
SCHEMBL9767683 0.91 POLB (0.40) OPRM1OPRL1POLBGAAMAPK1
SCHEMBL4873069 0.89 POLB (0.39) OPRM1OPRL1POLBGAAMAPK1

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
US-20230192949-A1 POLYCARBONATE RESIN, POLYCARBONATE RESIN COMPOSITION, OPTICAL MOLDED ARTICLE COMPRISING SAME, AND CYCLIC CARBONATE ASAHI KASEI KABUSHIKI KAISHA (JP) 2023-06-22 US disclosed
US-6232486-B1 PHOSPHATIDYLINOSITOL PHOSPHATE NUTRIMED BIOTECH 2001-05-15 US disclosed