SCHEMBL7948200

SCHEMBL7948200

O=S(=O)(C#Cc1ccccc1)c1ccccc1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.59
MTOR P42345 1/20 0.59
RAB9A P51151 1/20 0.59
CA2 P00918 7/20 0.50
CA12 O43570 6/20 0.50
CA9 Q16790 6/20 0.50
CA1 P00915 6/20 0.50
APP P05067 1/20 0.48
TSHR P16473 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
HTR6 P50406 1/20 0.44
CA7 P43166 2/20 0.41
ALDH1A1 P00352 1/20 0.41
HSD17B10 Q99714 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
CA3 P07451 1/20 0.41
CA4 P22748 1/20 0.41
CA6 P23280 1/20 0.41
CA5A P35218 1/20 0.41
PLA2G7 Q13093 1/20 0.41

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
SCHEMBL31619033 0.88 NPC1 (0.52) NPC1MTORRAB9ACA2CA12
SCHEMBL28281697 0.86 PKM (0.47) NPC1MTORRAB9ACA2CA12
SCHEMBL28705803 0.86 CA12 (0.50) NPC1MTORRAB9ACA2CA12
SCHEMBL28715043 0.86 NPC1 (0.50) NPC1MTORRAB9ACA2CA12
SCHEMBL28281734 0.86 NPC1 (0.46) NPC1MTORRAB9ACA2CA12
SCHEMBL28710707 0.86 NPC1 (0.46) NPC1MTORRAB9ACA2CA12
SCHEMBL28858455 0.86 NPC1 (0.55) NPC1MTORRAB9ACA2CA12
SCHEMBL28281703 0.86 NPC1 (0.46) NPC1MTORRAB9ACA2CA12
SCHEMBL28712504 0.82 NPC1 (0.50) NPC1MTORRAB9ACA2CA12
SCHEMBL28708712 0.82 HSD11B1 (0.44) NPC1MTORRAB9ACA2CA12

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114195687-B Beta-chloro tetra-substituted alkenyl sulfone compound and synthesis method thereof 华南理工大学 2023-06-20 CN disclosed
CN-114195687-A Beta-chloro tetra-substituted alkenyl sulfone compound and synthetic method thereof 华南理工大学 2022-03-18 CN disclosed
CN-111302986-B Preparation method of naphthol-based sulfone compound 佛山科学技术学院 2020-08-18 CN disclosed
CN-111302986-A Preparation method of naphthol-based sulfone compound 佛山科学技术学院 2020-06-19 CN disclosed
CN-109456237-A The synthetic method of alkynyl sulfone 怀化学院 2019-03-12 CN disclosed
CN-109096214-A A kind of preparation method of the novel trisubstituted 1,2,3- triazole of 4- sulfonyl -1,4,5- 大连理工大学 2018-12-28 CN disclosed
US-7635181-B2 Ink for ink jet-recording curable through irradiation with a radioactive ray and method for preparing lithographic printing plates using the same FUJIFILM CORPORATION (JP) 2009-12-22 US disclosed
US-7306894-B2 Polymerizable composition, photopolymerizing method and process for producing lithographic printing plate using the polymerizable composition FUJIFILM CORPORATION (JP) 2007-12-11 US disclosed
US-6255490-B1 TREATING DISORDERS ASSOCIATED WITH CHANGES IN CHOLINERGIC ACTIVITY; NON-OPIATE BASED ANALGESIC FOR MODERATE TO SEVERE PAIN EQUALLY OR EXCEEDING THE POTENCY OF OPIATE ANALGESICS, YET LACKING ADDICTIVE SIDE EFFECTS UNIVERSITY OF VIRGINIA 2001-07-03 US disclosed
US-6117889-A 7-Azabicyclo-[2.2.1]-heptane and -heptene derivatives as analgesics and anti-inflammatory agents UNIVERSITY OF VIRGINIA (US) 2000-09-12 US disclosed
US-6060473-A 7-azabicyclo[2.2.1]-heptane and -heptene derivatives as cholinergic receptor ligands UCB S.A. - DTB (BE) 2000-05-09 US disclosed
EP-0778835-A4 7-AZABICYCLO 2.2.1]-HEPTANE AND -HEPTENE DERIVATIVES AS CHOLINERGIC RECEPTOR LIGANDS UNIV VIRGINIA (US) 1999-02-03 EP disclosed
US-5817679-A ANALGESICS, ANTIINFLAMMATORY AGENTS UNIVERSITY OF VIRGINIA (US) 1998-10-06 US disclosed
EP-0778835-A1 7-AZABICYCLO 2.2.1]-HEPTANE AND -HEPTENE DERIVATIVES AS CHOLINERGIC RECEPTOR LIGANDS UNIVERSITY OF VIRGINIA (US) 1997-06-18 EP disclosed
WO-1996006093-A1 7-AZABICYCLO[2.2.1]-HEPTANE AND -HEPTENE DERIVATIVES AS CHOLINERGIC RECEPTOR LIGANDS UNIVERSITY OF VIRGINIA (US) 1996-02-29 WO disclosed
EP-0691971-A1 7-AZABICYCLO- 2.2.1]-HEPTANE AND -HEPTENE DERIVATIVES AS ANALGESICS AND ANTI-INFLAMMATORY AGENTS UNIVERSITY OF VIRGINIA (US) 1996-01-17 EP disclosed
WO-1994022868-A1 7-AZABICYCLO-[2.2.1]-HEPTANE AND -HEPTENE DERIVATIVES AS ANALGESICS AND ANTI-INFLAMMATORY AGENTS UNIVERSITY OF VIRGINIA (US) 1994-10-13 WO disclosed
US-4022804-A ADDITION REACTION; SULFONIC ACID BROMIDES, UNSATURATED COMPOUNDS BASF AKTIENGESELLSCHAFT (DT) 1977-05-10 US disclosed