Sugi Predict

Sugi Predict / Compounds / SCHEMBL358624

SCHEMBL358624

SCHEMBL358624

CCCCCCCCCCCCCC[P+](CCCCCC)(CCCCCC)CCCCCC.O=S(=O)([O-])C(F)(F)C(F)(F)C(F)(F)C(F)(F)F

nearest known ligand 0.44

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ DNM1 Q05193 2/20 0.44
▸ KCNH2 Q12809 6/20 0.35
▸ CES1 P23141 4/20 0.35
▸ CA1 P00915 2/20 0.34
▸ CA2 P00918 2/20 0.34
▸ MMP1 P03956 2/20 0.34
▸ MMP2 P08253 2/20 0.34
▸ MMP9 P14780 2/20 0.34
▸ MMP8 P22894 2/20 0.34
▸ MMP13 P45452 2/20 0.34
▸ EPHX1 P07099 1/20 0.34
▸ RECQL P46063 2/20 0.33
▸ GLA P06280 1/20 0.33
▸ HPGD P15428 1/20 0.33
▸ TSHR P16473 1/20 0.33
▸ MAPK1 P28482 1/20 0.33
▸ EPHX2 P34913 1/20 0.33
▸ BLM P54132 1/20 0.33
▸ FAAH O00519 1/20 0.32

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
SCHEMBL21986603 0.98 DNM1 (0.42) DNM1KCNH2CES1CA1CA2
SCHEMBL4450854 0.98 DNM1 (0.47) DNM1KCNH2CES1CA1CA2
SCHEMBL21986624 0.98 DNM1 (0.42) DNM1KCNH2CES1CA1CA2
SCHEMBL123514 0.93 DNM1 (0.38) DNM1KCNH2CES1CA1CA2
SCHEMBL23088858 0.84 CA2 (0.33) DNM1CA1CA2MMP1MMP2
SCHEMBL21986582 0.84 CA2 (0.33) DNM1CA1CA2MMP1MMP2
Trifluoromethanesulfonic Acid SCHEMBL28987659 0.83 DNM1 (0.54) DNM1KCNH2CES1EPHX1RECQL
Trifluoromethanesulfonic Acid SCHEMBL2865203 0.83 DNM1 (0.54) DNM1KCNH2CES1EPHX1RECQL
Trifluoromethanesulfonic Acid SCHEMBL2761030 0.83 DNM1 (0.54) DNM1KCNH2CES1EPHX1RECQL
Tetrahexylammonium SCHEMBL29701291 0.82 SLC22A1 (0.43) DNM1KCNH2TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2714872-B1 HIGH TEMPERATURE LUBRICATING OIL KLÜBER LUBRICATION MÜNCHEN SE & CO KG (DE) 2016-08-03 — — EP claimed
EP-2414476-A1 IONIC COMPOUNDS IN LITHIUM BROMIDE/WATER ABSORPTION CYCLE SYSTEMS E. I. du Pont de Nemours and Company (US) 2012-02-08 — — EP claimed
US-20120011886-A1 IONIC COMPOUNDS IN LITHIUM BROMIDE/WATER ABSORPTION CYCLE SYSTEMS E. I. DU PONT DE NEMOURS AND COMPANY 2012-01-19 — — US claimed
WO-2010117836-A1 IONIC COMPOUNDS IN LITHIUM BROMIDE/WATER ABSORPTION CYCLE SYSTEMS E. I. DU PONT DE NEMOURS AND COMPANY (US) 2010-10-14 — — WO claimed
CN-110869319-A Method for dinitrogen conversion, battery and electrolyte 莫纳什大学 2020-03-06 — — CN disclosed
EP-2714872-B1 HIGH TEMPERATURE LUBRICATING OIL KLÜBER LUBRICATION MÜNCHEN SE & CO KG (DE) 2016-08-03 — — EP disclosed
WO-2012159738-A1 HIGH TEMPERATURE OIL KLÜBER LUBRICATION MÜNCHEN SE & CO. KG (DE) 2012-11-29 — — WO disclosed
EP-2414476-A1 IONIC COMPOUNDS IN LITHIUM BROMIDE/WATER ABSORPTION CYCLE SYSTEMS E. I. du Pont de Nemours and Company (US) 2012-02-08 — — EP disclosed
US-20120011886-A1 IONIC COMPOUNDS IN LITHIUM BROMIDE/WATER ABSORPTION CYCLE SYSTEMS E. I. DU PONT DE NEMOURS AND COMPANY 2012-01-19 — — US disclosed
WO-2010117836-A1 IONIC COMPOUNDS IN LITHIUM BROMIDE/WATER ABSORPTION CYCLE SYSTEMS E. I. DU PONT DE NEMOURS AND COMPANY (US) 2010-10-14 — — WO disclosed
EP-2185642-A1 FLAME RETARDANT POLYTRIMETHYLENE TEREPHTHALATE COMPOSITION E. I. du Pont de Nemours and Company (US) 2010-05-19 — — EP disclosed
WO-2009020947-A1 FLAME RETARDANT POLYTRIMETHYLENE TEREPHTHALATE COMPOSITION E. I. DU PONT DE NEMOURS AND COMPANY (US) 2009-02-12 — — WO disclosed
US-20090043017-A1 FLAME RETARDANT POLYTRIMETHYLENE TEREPHTHALATE COMPOSITION E. I. DU PONT DE NEMOURS AND COMPANY 2009-02-12 — — US disclosed