SCHEMBL11791941

SCHEMBL11791941

CCCCCCCCCCCCS(=O)(=O)C(=CNc1ccc(OCCCC)cc1)S(=O)(=O)CCCCCCCCCCCC

nearest known ligand 0.51

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ NPC1 O15118 1/20 0.51
▸ RAB9A P51151 1/20 0.51
▸ CA12 O43570 1/20 0.45
▸ CA1 P00915 1/20 0.45
▸ CA2 P00918 1/20 0.45
▸ CA9 Q16790 1/20 0.45
▸ FAAH O00519 12/20 0.44
▸ NR5A1 Q13285 1/20 0.44
▸ TP53 P04637 1/20 0.43
▸ TSHR P16473 1/20 0.43
▸ LMNA P02545 1/20 0.43
▸ SMN1; SMN2 Q16637 1/20 0.43

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
SCHEMBL11785931 0.85 MAPT (0.50) NPC1RAB9ATSHRLMNA
SCHEMBL11789722 0.85 MAPT (0.50) NPC1RAB9ATSHRLMNA
SCHEMBL11787747 0.78 GAA (0.39) CA12CA1CA2CA9TSHR
SCHEMBL11786058 0.77 MAPT (0.47) SMN1; SMN2
SCHEMBL7073051 0.75 TP53 (0.51) NPC1RAB9AFAAHTP53TSHR
SCHEMBL2089958 0.74 NPC1 (0.58) NPC1RAB9AFAAHNR5A1TP53
SCHEMBL5948127 0.74 NPC1 (0.58) NPC1RAB9AFAAHNR5A1TP53
SCHEMBL7929814 0.74 NPC1 (0.58) NPC1RAB9AFAAHNR5A1TP53
SCHEMBL19946498 0.74 NPC1 (0.58) NPC1RAB9AFAAHNR5A1TP53
SCHEMBL7930488 0.74 NPC1 (0.58) NPC1RAB9AFAAHNR5A1TP53

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-3954707-A Polymers stabilized by bis(alkylsulfonyl)vinylanilines AMERICAN CYANAMID COMPANY (US) 1976-05-04 — — US disclosed
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