SCHEMBL565716

SCHEMBL565716

C1CCCc2nc3c(nc2CC1)CCCCCC3

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACHE P22303 3/20 0.50
KMT2A Q03164 2/20 0.48
ALDH1A1 P00352 2/20 0.48
KDM4E B2RXH2 2/20 0.48
MEN1 O00255 1/20 0.48
MAPK1 P28482 1/20 0.48
BPTF Q12830 1/20 0.48
APAF1 O14727 1/20 0.48
NSD2 O96028 1/20 0.48
TP53 P04637 1/20 0.48
MAPT P10636 1/20 0.48
CASP3 P42574 1/20 0.48
SENP8 Q96LD8 1/20 0.48
SENP7 Q9BQF6 1/20 0.48
SENP6 Q9GZR1 1/20 0.48
TDP1 Q9NUW8 1/20 0.48
L3MBTL1 Q9Y468 1/20 0.48
NPC1 O15118 1/20 0.46
RAB9A P51151 1/20 0.46
CYP1A2 P05177 2/20 0.42

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
SCHEMBL2406021 0.96 ACHE (0.53) ACHEKMT2AALDH1A1KDM4EMEN1
SCHEMBL14572401 0.92 ACHE (0.55) ACHEKMT2AALDH1A1KDM4EMEN1
SCHEMBL14572400 0.87 ACHE (0.50) ACHEKMT2AALDH1A1KDM4EMEN1
SCHEMBL14380308 0.80 KDM4E (0.46) ACHEKMT2AALDH1A1KDM4EMEN1
SCHEMBL13197744 0.80 KDM4E (0.46) ACHEKMT2AALDH1A1KDM4EMEN1
SCHEMBL25457780 0.79 NSD2 (0.45) ACHEKMT2AALDH1A1KDM4EMEN1
SCHEMBL14219667 0.79 NSD2 (0.45) ACHEKMT2AALDH1A1KDM4EMEN1
SCHEMBL22863612 0.77 NPC1 (0.42) ACHEKMT2AALDH1A1KDM4EMEN1
SCHEMBL12507659 0.75 SMN1; SMN2 (0.48) ALDH1A1KDM4EMAPTNPC1RAB9A
SCHEMBL11729324 0.75 SMN1; SMN2 (0.48) ALDH1A1KDM4EMAPTNPC1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20160068633-A1 METHODS AND SYSTEMS FOR THE RECOVERY OF WATER FROM A POLYAMIDE SYNTHESIS PROCESS INVISTA NORTH AMERICA S.A R.L. (US) 2016-03-10 US disclosed
US-20160060395-A1 METHODS AND SYSTEMS FOR THE RECOVERY OF WATER FROM A POLYAMIDE SYNTHESIS PROCESS INVISTA NORTH AMERICA S.A R.L. (US) 2016-03-03 US disclosed
WO-2014179025-A1 METHODS AND SYSTEMS FOR THE RECOVERY OF WATER FROM A POLYAMIDE SYNTHESIS PROCESS INVISTA TECHNOLOGIES S.A.R.L. (CH) 2014-11-06 WO disclosed
WO-2014179029-A1 METHODS AND SYSTEMS FOR THE RECOVERY OF WATER FROM A POLYAMIDE SYNTHESIS PROCESS INVISTA NORTH AMERICA S.A.R.L. (US) 2014-11-06 WO disclosed
EP-1978134-B1 Metal plating compositions ROHM & HAAS ELECT MAT (US) 2013-09-11 EP disclosed
US-8337688-B2 Metal plating compositions ROHM AND HAAS ELECTRONIC MATERIALS LLC (US) 2012-12-25 US disclosed
US-20120034371-A1 METAL PLATING COMPOSITIONS ROHM AND HAAS ELECTRONIC MATERIALS LLC (US) 2012-02-09 US disclosed
US-8048284-B2 Mixture of metal compound and polyamideether copolymer; electrical or decorative article; printed circuits; improved leveling and throwing power ROHM AND HAAS ELECTRONIC MATERIALS LLC (US) 2011-11-01 US disclosed
US-20080269395-A1 Metal plating compositions ROHM AND HAAS ELECTRONIC MATERIALS LLC (US) 2008-10-30 US disclosed
EP-1978134-A1 Metal plating compositions Rohm and Haas Electronic Materials LLC (US) 2008-10-08 EP disclosed