SCHEMBL30644745

SCHEMBL30644745

CC(C)(C)OC(=O)NS(=O)(=O)N[C@H]1CCc2c(C(=O)Nc3ccc(F)c(Cl)c3)ccc(F)c21

nearest known ligand 0.42

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 4/20 0.42
▸ NPSR1 Q6W5P4 2/20 0.42
▸ CNR1 P21554 1/20 0.42
▸ GPR35 Q9HC97 1/20 0.42
▸ GPR55 Q9Y2T6 1/20 0.42
▸ KMT2A Q03164 2/20 0.42
▸ RORC P51449 8/20 0.41
▸ LMNA P02545 1/20 0.41
▸ TP53 P04637 1/20 0.41
▸ FADS1 O60427 1/20 0.38
▸ SMN1; SMN2 Q16637 1/20 0.38
▸ HTT P42858 1/20 0.38
▸ MEN1 O00255 1/20 0.37
▸ ALDH1A1 P00352 1/20 0.37

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
SCHEMBL26597500 1.00 MAPT (0.42) MAPTNPSR1CNR1GPR35GPR55
SCHEMBL20510119 0.88 MAPT (0.46) MAPTNPSR1CNR1GPR35GPR55
SCHEMBL21465702 0.87 KMT2A (0.45) MAPTNPSR1CNR1GPR35GPR55
SCHEMBL26597490 0.87 NPSR1 (0.45) MAPTNPSR1KMT2ALMNATP53
SCHEMBL26597487 0.87 NPSR1 (0.45) MAPTNPSR1KMT2ALMNATP53
SCHEMBL20511717 0.86 KMT2A (0.47) MAPTNPSR1KMT2ALMNATP53
SCHEMBL29656495 0.86 KMT2A (0.47) MAPTNPSR1KMT2ALMNATP53
SCHEMBL30644688 0.85 KMT2A (0.44) MAPTNPSR1CNR1GPR35GPR55
SCHEMBL26597431 0.85 KMT2A (0.44) MAPTNPSR1CNR1GPR35GPR55
SCHEMBL29656407 0.84 KMT2A (0.47) MAPTNPSR1KMT2ALMNATP53

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
EP-3601216-B1 SUBSTITUTED DIHYDROINDENE-4-CARBOXAMIDES AND ANALOGS THEREOF, AND METHODS USING SAME FOR THE TREATMENT OF HEPATITIS B VIRUS INFECTION ARBUTUS BIOPHARMA CORP (CA) 2023-10-25 — — EP disclosed
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