SCHEMBL6905535

SCHEMBL6905535

CCCSc1cc(SCCC)c(N)c(C)c1N

nearest known ligand 0.38

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 1/20 0.38
TLR8 Q9NR97 1/20 0.37
MAPT P10636 1/20 0.35
ALDH1A1 P00352 2/20 0.33
LMNA P02545 2/20 0.33
HPGD P15428 2/20 0.33
CYP1A2 P05177 1/20 0.33
PTGS2 P35354 1/20 0.33
CA12 O43570 1/20 0.32
CA1 P00915 1/20 0.32
CA2 P00918 1/20 0.32
CA7 P43166 1/20 0.32
CA13 Q8N1Q1 1/20 0.32
MAOA P21397 1/20 0.32
MAOB P27338 1/20 0.32
HASPIN Q8TF76 1/20 0.31
KDM4E B2RXH2 3/20 0.31
ABL1 P00519 1/20 0.31
RIN1 Q13671 1/20 0.31

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
SCHEMBL6911625 0.89 TLR8 (0.46) TLR8ALDH1A1HPGDPTGS2MAOA
SCHEMBL48321 0.82 AOC3 (0.36) MAPTALDH1A1
SCHEMBL16279674 0.78 PTGS2 (0.39) KMT2ATLR8MAPTALDH1A1HPGD
SCHEMBL9009906 0.78 PTGS2 (0.37) KMT2ATLR8MAPTALDH1A1LMNA
SCHEMBL6912224 0.76 KMT2A (0.34) KMT2ATLR8MAPTALDH1A1LMNA
SCHEMBL6910768 0.75 AOC3 (0.32)
SCHEMBL8764984 0.75 KMT2A (0.33) KMT2AMAPT
SCHEMBL6912551 0.73 CA12 (0.37) KMT2AMAPTALDH1A1LMNAHPGD
SCHEMBL9179742 0.72 ALDH1A1 (0.36) MAPTALDH1A1LMNA
SCHEMBL5522764 0.71 ALDH1A1 (0.33) MAPTALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0591059-B1 Use of sulfur-containing metaphenylenediamines for dyeing keratinic fibers and new sulfur-containing metaphenylenediamines OREAL (FR) 1998-04-15 EP claimed
EP-0591059-A1 Use of sulfur-containing metaphenylenediamines for dyeing keratinic fibers and new sulfur-containing metaphenylenediamines L'OREAL (FR) 1994-04-06 EP claimed
EP-1265940-B1 AROMATIC AMINE CURATIVES AND THEIR USE ALBERMARLE CORP (US) 2004-10-27 EP disclosed
US-6509434-B1 Condensation polymerization of alkylthiated mononuclear aromatic amines and isocyanate prepolymer to produce polyurethanes, polyureaurethanes and/or polyureas ALBEMARLE CORPORATION 2003-01-21 US disclosed
EP-1265940-A2 AROMATIC AMINE CURATIVES AND THEIR USE Albermarle Corporation (US) 2002-12-18 EP disclosed
WO-2001070841-A2 AROMATIC AMINE CURATIVES AND THEIR USE ALBEMARLE CORPORATION (US) 2001-09-27 WO disclosed
EP-0591059-B1 Use of sulfur-containing metaphenylenediamines for dyeing keratinic fibers and new sulfur-containing metaphenylenediamines OREAL (FR) 1998-04-15 EP disclosed
US-5534036-A Keratinous fiber dyeing methods and compositions which contain sulfated methaphenylenediamine couplers in combination with oxidation dye precursors L'OREAL (FR) 1996-07-09 US disclosed
EP-0591059-A1 Use of sulfur-containing metaphenylenediamines for dyeing keratinic fibers and new sulfur-containing metaphenylenediamines L'OREAL (FR) 1994-04-06 EP disclosed
EP-0193872-B1 DI(ALKYLTHIO) DIAMINE CHAIN EXTENDERS FOR POLYURETHANE ELASTOMERS ETHYL CORPORATION (US) 1993-03-31 EP disclosed
EP-0228190-B1 RIM POLYURETHANES COMPRISING MIXED DIAMINE CHAIN EXTENDERS AND PROCESS AND COMPOSITION FOR THEIR PRODUCTION ETHYL CORPORATION (US) 1991-02-27 EP disclosed
EP-0329821-A2 Polyhydroxyalkane/aromatic diamine chain extenders ETHYL CORPORATION (US) 1989-08-30 EP disclosed
EP-0228190-A2 RIM polyurethanes comprising mixed diamine chain extenders and process and composition for their production ETHYL CORPORATION (US) 1987-07-08 EP disclosed
US-4631298-A REACTION INJECTION MOLDING POLYURETHANES ETHYL CORPORATION (US) 1986-12-23 US disclosed
EP-0193872-A2 Di(alkylthio) diamine chain extenders for polyurethane elastomers ETHYL CORPORATION (US) 1986-09-10 EP disclosed
US-4595742-A Formed by reacting polyisocyanate, an organic active hydrogen group containing compound, and a chain extender comprising an aromatic diamine ETHYL CORPORATION (US) 1986-06-17 US disclosed