SCHEMBL1027238

SCHEMBL1027238

[Ru].c1cnc(-c2nccs2)cn1.c1cnc(-c2nccs2)cn1.c1cnc(-c2nccs2)cn1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP2A6 P11509 1/20 0.48
HSP90AA1 P07900 1/20 0.43
HDAC1 Q13547 1/20 0.41
HDAC8 Q9BY41 1/20 0.41
HDAC6 Q9UBN7 1/20 0.41
HTT P42858 1/20 0.41
RECQL P46063 1/20 0.41
PDPK1 O15530 1/20 0.41
RAB9A P51151 1/20 0.41
ADORA2A P29274 1/20 0.39
ADORA1 P30542 1/20 0.39
DCTPP1 Q9H773 1/20 0.38
SYK P43405 3/20 0.38
CDC7 O00311 1/20 0.38
DBF4 Q9UBU7 1/20 0.38
CYP1A2 P05177 2/20 0.37
KDM4E B2RXH2 1/20 0.37
ALDH1A1 P00352 1/20 0.37
TERT O14746 3/20 0.37
SPHK2 Q9NRA0 1/20 0.37

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
SCHEMBL29791140 0.98 CYP2A6 (0.50) CYP2A6HSP90AA1HDAC1HDAC8HDAC6
SCHEMBL902694 0.98 CYP2A6 (0.50) CYP2A6HSP90AA1HDAC1HDAC8HDAC6
SCHEMBL27616104 0.75 CYP2A6 (0.49) CYP2A6HSP90AA1PDPK1RAB9AADORA2A
SCHEMBL27616221 0.75 CYP2A6 (0.49) CYP2A6HSP90AA1PDPK1RAB9AADORA2A
SCHEMBL9794662 0.74 NISCH (0.48) HSP90AA1HTTRECQLRAB9ACYP1A2
SCHEMBL14053846 0.74 NISCH (0.48) HSP90AA1HTTRECQLRAB9ACYP1A2
SCHEMBL30511083 0.73
Hydrochloric Acid SCHEMBL30272980 0.71 NISCH (0.46) HSP90AA1HTTRECQLRAB9ACYP1A2
SCHEMBL102331 0.71 PDPK1 (0.59) CYP2A6HSP90AA1PDPK1RAB9AADORA2A
SCHEMBL78566 0.71 NISCH (0.50) HSP90AA1HTTRECQLRAB9ACYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2154942-B1 OXYGEN-CONTROLED PRIMING OF SEED FYTAGORAS B V (NL) 2020-02-12 EP disclosed
EP-2273865-B1 METHOD FOR SORTING A PLURALITY OF GROWTH-INDUCED SEEDS FOR COMMERCIAL USE BALL HORTICULTURAL CO (US) 2017-07-19 EP disclosed
US-8613158-B2 Method for grouping a plurality of growth-induced seeds for commercial use or sale based on testing of each individual seed BALL HORTICULTURAL COMPANY (US) 2013-12-24 US disclosed
US-8381438-B2 Oxygen-controlled priming of seed FYTAGORAS (NL) 2013-02-26 US disclosed
EP-2273865-A1 METHOD FOR SORTING A PLURALITY OF GROWTH-INDUCED SEEDS FOR COMMERCIAL USE Ball Horticultural Company (US) 2011-01-19 EP disclosed
US-20100186297-A1 OXYGEN-CONTROLLED PRIMING OF SEED FYTAGORAS (NL) 2010-07-29 US disclosed
EP-2154942-A1 OXYGEN-CONTROLED PRIMING OF SEED Fytagoras (NL) 2010-02-24 EP disclosed
US-20090260281-A1 METHOD FOR GROUPING A PLURALITY OF GROWTH-INDUCED SEEDS FOR COMMERCIAL USE OR SALE BASED ON TESTING OF EACH INDIVIDUAL SEED BALL HORTICULTURAL COMPANY (US) 2009-10-22 US disclosed
WO-2009128998-A1 METHOD FOR SORTING A PLURALITY OF GROWTH-INDUCED SEEDS FOR COMMERCIAL USE BALL HORTICULTURAL COMPANY (US) 2009-10-22 WO disclosed
WO-2008153388-A1 OXYGEN-CONTROLED PRIMING OF SEED FYTAGORAS (NL) 2008-12-18 WO disclosed
US-20040033575-A1 Measuring metabolic rate changes NEDERLANDSE ORGAISATIE VOOR TOEGEPAST-NATUURWETENSCHAPPELIJK ONDERZOEK TNO (NL) 2004-02-19 US disclosed
EP-1264176-A1 MEASURING METABOLIC RATE CHANGES Nederlandse Organisatie voor toegepast-natuurwetenschappelijk Onderzoek TNO (NL) 2002-12-11 EP disclosed
WO-2001069243-A1 MEASURING METABOLIC RATE CHANGES NEDERLANDSE ORGANISATIE VOOR TOEGEPAST-NATUURWETENSCHAPPELIJK ONDERZOEK TNO (NL) 2001-09-20 WO disclosed
EP-1134583-A1 Measuring metabolic rate changes Nederlandse Organisatie voor toegepast-natuurwetenschappelijk Onderzoek TNO (NL) 2001-09-19 EP disclosed