SCHEMBL24106966

SCHEMBL24106966

CC(O)c1ccc(S(=O)(=O)N2CC(=O)NC23CCNCC3)cc1

nearest known ligand 0.36

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ GFER P55789 1/20 0.36
▸ HSD11B1 P28845 1/20 0.34
▸ CHRM2 P08172 1/20 0.34
▸ CHRM1 P11229 1/20 0.34
▸ AKR1B1 P15121 2/20 0.33
▸ POLB P06746 1/20 0.33
▸ ALDH1A1 P00352 1/20 0.33
▸ HTR6 P50406 8/20 0.32
▸ MCOLN3 Q8TDD5 1/20 0.31
▸ MAPT P10636 1/20 0.31
▸ OPRD1 P41143 1/20 0.31
▸ GPR183 P32249 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
SCHEMBL12624024 0.81 GFER (0.56) GFERHSD11B1AKR1B1POLBALDH1A1
SCHEMBL20791736 0.75 L3MBTL1 (0.51) POLBALDH1A1
SCHEMBL20019616 0.70 GFER (0.54) GFERHSD11B1AKR1B1POLBALDH1A1
SCHEMBL12622139 0.70 GFER (0.60) GFERPOLBALDH1A1MAPT
SCHEMBL12626996 0.64 GFER (0.47) GFERALDH1A1MAPT
SCHEMBL12622104 0.63 POLB (0.55) POLBALDH1A1
SCHEMBL15424229 0.63 — —
SCHEMBL20019612 0.63 POLB (0.45) POLBALDH1A1MCOLN3MAPT
SCHEMBL12624048 0.63 POLB (0.54) POLBALDH1A1MCOLN3
SCHEMBL13363622 0.62 NEK2 (0.38) —

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
US-20210389298-A1 Alzheimer's Disease Assay in a Living Patient PAIN THERAPEUTICS, INC. (US) 2021-12-16 — — US disclosed
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