SCHEMBL4652266

SCHEMBL4652266

C=CC=CC(=O)c1ccc(N2CCCCC2)cc1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CTSL P07711 3/20 0.57
▸ CTSB P07858 3/20 0.57
▸ NPC1 O15118 5/20 0.50
▸ RAB9A P51151 5/20 0.50
▸ ALDH1A1 P00352 5/20 0.49
▸ MAPT P10636 5/20 0.49
▸ SMN1; SMN2 Q16637 4/20 0.49
▸ HPGD P15428 3/20 0.49
▸ TP53 P04637 3/20 0.49
▸ ALOX15 P16050 3/20 0.49
▸ TSHR P16473 2/20 0.49
▸ L3MBTL1 Q9Y468 2/20 0.49
▸ LMNA P02545 1/20 0.49
▸ STAT1 P42224 1/20 0.49
▸ HSD17B10 Q99714 1/20 0.49
▸ HDAC6 Q9UBN7 1/20 0.49
▸ KDM4E B2RXH2 2/20 0.47
▸ MAPK1 P28482 2/20 0.47
▸ PTGS2 P35354 1/20 0.47
▸ CASP1 P29466 1/20 0.47

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
SCHEMBL6263968 0.98 CTSL (0.58) CTSLCTSBNPC1RAB9AALDH1A1
SCHEMBL6262087 0.86 MAOB (0.62) NPC1RAB9AALDH1A1MAPTSMN1; SMN2
SCHEMBL30382984 0.83 NPC1 (0.56) CTSLCTSBNPC1RAB9AALDH1A1
SCHEMBL15864453 0.78 NPC1 (0.57) CTSLCTSBNPC1RAB9AALDH1A1
SCHEMBL29055983 0.77 PTGS2 (0.60) CTSLCTSBNPC1RAB9AALDH1A1
SCHEMBL31671057 0.76 CTSL (0.62) CTSLCTSBNPC1RAB9AALDH1A1
SCHEMBL21749654 0.76 MAOB (0.77) CTSLCTSBNPC1RAB9AALDH1A1
SCHEMBL25202513 0.75 CTSL (0.77) CTSLCTSBNPC1RAB9AALDH1A1
SCHEMBL25195112 0.75 CTSL (0.77) CTSLCTSBNPC1RAB9AALDH1A1
SCHEMBL25236835 0.75 CTSL (0.77) CTSLCTSBNPC1RAB9AALDH1A1

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-1434557-B1 AGENT FOR THE COLORATION OF KERATIN-CONTAINING FIBERS HENKEL KGAA (DE) 2005-11-09 — — EP claimed
EP-1434557-A1 AGENT FOR THE COLORATION OF KERATIN-CONTAINING FIBERS Henkel Kommanditgesellschaft auf Aktien (DE) 2004-07-07 — — EP claimed
WO-2003030845-A1 AGENT FOR THE COLORATION OF KERATIN-CONTAINING FIBERS HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 2003-04-17 — — WO claimed
EP-1112055-A1 AGENTS FOR DYEING FIBRES CONTAINING KERATIN Henkel Kommanditgesellschaft auf Aktien (DE) 2001-07-04 — — EP claimed
WO-2000015183-A1 AGENTS FOR DYEING FIBRES CONTAINING KERATIN HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 2000-03-23 — — WO claimed
EP-1986592-A2 OXIDATIVE HAIR TREATING AGENT HAVING A GINSENG EXTRACT Henkel AG & Co. KGaA (DE) 2008-11-05 — — EP disclosed
WO-2007090527-A2 OXIDATIVE HAIR TREATING AGENT HAVING A GINSENG EXTRACT HENKEL AG & CO. KGAA (DE) 2007-08-16 — — WO disclosed
WO-2006102987-A1 AGENTS FOR COLOURING FIBRES CONTAINING KERATIN HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 2006-10-05 — — WO disclosed
EP-1434557-B1 AGENT FOR THE COLORATION OF KERATIN-CONTAINING FIBERS HENKEL KGAA (DE) 2005-11-09 — — EP disclosed
EP-1434557-A1 AGENT FOR THE COLORATION OF KERATIN-CONTAINING FIBERS Henkel Kommanditgesellschaft auf Aktien (DE) 2004-07-07 — — EP disclosed
WO-2003030845-A1 AGENT FOR THE COLORATION OF KERATIN-CONTAINING FIBERS HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 2003-04-17 — — WO disclosed
EP-1112055-A1 AGENTS FOR DYEING FIBRES CONTAINING KERATIN Henkel Kommanditgesellschaft auf Aktien (DE) 2001-07-04 — — EP disclosed
WO-2000015183-A1 AGENTS FOR DYEING FIBRES CONTAINING KERATIN HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 2000-03-23 — — WO disclosed
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