SCHEMBL1687895

SCHEMBL1687895

Cc1ccc(S(=O)(=O)OCCCN)cc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 4/20 0.44
▸ CYP3A4 P08684 1/20 0.44
▸ CYP2C9 P11712 1/20 0.44
▸ CYP2C19 P33261 1/20 0.44
▸ CA1 P00915 3/20 0.44
▸ CA9 Q16790 3/20 0.44
▸ CA12 O43570 2/20 0.44
▸ CA2 P00918 2/20 0.44
▸ CA3 P07451 1/20 0.44
▸ CA6 P23280 1/20 0.44
▸ CA5A P35218 1/20 0.44
▸ CA7 P43166 1/20 0.44
▸ CA5B Q9Y2D0 1/20 0.44
▸ GAA P10253 1/20 0.42
▸ PSMD10 O75832 1/20 0.42
▸ STAT3 P40763 1/20 0.41
▸ CYP24A1 Q07973 2/20 0.41
▸ P2RY12 Q9H244 1/20 0.41
▸ G6PD P11413 1/20 0.41
▸ VDR P11473 1/20 0.39

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
Hydrochloric Acid SCHEMBL28969274 0.98 ALDH1A1 (0.43) ALDH1A1CYP3A4CYP2C9CYP2C19CA1
SCHEMBL20856190 0.95 ALDH1A1 (0.43) ALDH1A1CYP3A4CYP2C9CYP2C19CA1
SCHEMBL30573752 0.93 ALDH1A1 (0.42) ALDH1A1CYP3A4CYP2C9CYP2C19CA1
SCHEMBL14146858 0.93 ALDH1A1 (0.42) ALDH1A1CYP3A4CYP2C9CYP2C19CA1
SCHEMBL7535395 0.93 ALDH1A1 (0.42) ALDH1A1CYP3A4CYP2C9CYP2C19CA1
SCHEMBL20261700 0.93 ALDH1A1 (0.42) ALDH1A1CYP3A4CYP2C9CYP2C19CA1
SCHEMBL8343815 0.93 ALDH1A1 (0.42) ALDH1A1CYP3A4CYP2C9CYP2C19CA1
SCHEMBL3975259 0.89 CA1 (0.47) ALDH1A1CYP3A4CYP2C9CYP2C19CA1
SCHEMBL483847 0.89 ALDH1A1 (0.50) ALDH1A1CYP3A4CYP2C9CYP2C19CA1
SCHEMBL890725 0.89 ALDH1A1 (0.50) ALDH1A1CYP3A4CYP2C9CYP2C19CA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-105771596-B A kind of floriculture greenhouse greenhouse emission regeneration treatment equipment and its method of work 徐州工程学院 2018-04-03 — — CN claimed
CN-105771596-A Regenerative treatment equipment of exhaust from flower greenhouse and working method thereof 徐州工程学院 2016-07-20 — — CN claimed
CN-115667230-A Triazines with thiosulfonate end groups and process for their preparation 弗雷克斯系统美国公司 2023-01-31 — — CN disclosed
CN-105771596-B A kind of floriculture greenhouse greenhouse emission regeneration treatment equipment and its method of work 徐州工程学院 2018-04-03 — — CN disclosed
CN-105771596-A Regenerative treatment equipment of exhaust from flower greenhouse and working method thereof 徐州工程学院 2016-07-20 — — CN disclosed
WO-2012047762-A2 ANTIFUNGAL AGENTS AMPLYX PHARMACEUTICALS, INC. (US) 2012-04-12 — — WO disclosed
EP-2133349-B1 Kinase inhibitors TAKEDA PHARMACEUTICAL (JP) 2011-01-12 — — EP disclosed
EP-2133349-A1 Kinase inhibitors Takeda San Diego, Inc. (US) 2009-12-16 — — EP disclosed
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