SCHEMBL629136

SCHEMBL629136

COCN1c2ccccc2Sc2ccccc21

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM1A O60341 4/20 0.53
▸ PTGS1 P23219 3/20 0.53
▸ PTGS2 P35354 2/20 0.53
▸ MAOA P21397 2/20 0.52
▸ CYP2D6 P10635 5/20 0.50
▸ CHRM2 P08172 4/20 0.50
▸ HTR1A P08908 4/20 0.50
▸ ADRA2A P08913 4/20 0.50
▸ CHRM1 P11229 4/20 0.50
▸ DRD1 P21728 4/20 0.50
▸ SLC6A2 P23975 4/20 0.50
▸ SLC6A4 P31645 4/20 0.50
▸ ADRA1A P35348 4/20 0.50
▸ OPRM1 P35372 4/20 0.50
▸ DRD3 P35462 4/20 0.50
▸ KCNH2 Q12809 4/20 0.50
▸ LMNA P02545 4/20 0.50
▸ SLC22A1 O15245 3/20 0.50
▸ CYP1A2 P05177 3/20 0.50
▸ HIF1A Q16665 3/20 0.50

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
SCHEMBL4952235 0.91 KDM1A (0.46) KDM1APTGS1PTGS2MAOACYP2D6
SCHEMBL5484265 0.83 LMNA (0.42) KDM1ADRD3LMNAALDH1A1DRD2
SCHEMBL18550498 0.81 KDM1A (0.59) KDM1APTGS1PTGS2MAOACYP2D6
SCHEMBL30622707 0.81 KDM1A (0.59) KDM1APTGS1PTGS2MAOACYP2D6
SCHEMBL29557425 0.77 KDM1A (0.61) KDM1APTGS1PTGS2MAOACYP2D6
SCHEMBL293951 0.77 KDM1A (0.61) KDM1APTGS1PTGS2MAOACYP2D6
SCHEMBL29459667 0.75 KDM1A (0.53) KDM1ACYP2D6CHRM2HTR1AADRA2A
SCHEMBL18890496 0.75 KDM1A (0.53) KDM1ACYP2D6CHRM2HTR1AADRA2A
SCHEMBL29795163 0.73 KDM1A (0.65) KDM1APTGS1PTGS2MAOACYP2D6
SCHEMBL31123118 0.73 KDM1A (0.65) KDM1APTGS1PTGS2MAOACYP2D6

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
US-20060263697-A1 Substituted phenothiazine redox shuttles for rechargeable lithium-ion cell 3M INNOVATIVE PROPERTIES COMPANY 2006-11-23 — — US claimed
EP-1883987-B1 SUBSTITUTED PHENOTHIAZINE REDOX SHUTTLES FOR RECHARGEABLE LITHIUM-ION CELL 3M INNOVATIVE PROPERTIES CO (US) 2012-02-22 — — EP disclosed
US-7615312-B2 Electrolytic cells; phenothiazine compound has oxidation potential above positive electrode recharged potential and serves as cyclable redox chemical shuttle providing cell overcharge protection 3M INNOVATIVE PROPERTIES COMPANY (US) 2009-11-10 — — US disclosed
EP-1883987-A1 SUBSTITUTED PHENOTHIAZINE REDOX SHUTTLES FOR RECHARGEABLE LITHIUM-ION CELL 3M Innovative Properties Company (US) 2008-02-06 — — EP disclosed
WO-2006124738-A1 SUBSTITUTED PHENOTHIAZINE REDOX SHUTTLES FOR RECHARGEABLE LITHIUM-ION CELL 3M INNOVATIVE PROPERTIES COMPANY (US) 2006-11-23 — — WO disclosed
US-20060263697-A1 Substituted phenothiazine redox shuttles for rechargeable lithium-ion cell 3M INNOVATIVE PROPERTIES COMPANY 2006-11-23 — — US disclosed
EP-0213956-B1 PYRROLIZIDINE PHARMACEUTICAL COMPOUNDS AND COMPOSITIONS AND THEIR PREPARATION SANWA KAGAKU KENKYUSHO CO., LTD. (JP) 1990-04-04 — — EP disclosed
US-4734411-A ANTIULCER SANWA KAGAKU KENKYUSHO CO., LTD. (JP) 1988-03-29 — — US disclosed
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