SCHEMBL6024059

SCHEMBL6024059

CCCCC[C](CCCC)C1CCCCC1

nearest known ligand 0.46

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
NAAA Q02083 3/20 0.46
CYP1A2 P05177 1/20 0.41
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
EPHX1 P07099 9/20 0.37
SIGMAR1 Q99720 2/20 0.37
EPHX2 P34913 2/20 0.36

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
SCHEMBL16702937 0.96 NAAA (0.50) NAAACYP1A2EPHX1SIGMAR1EPHX2
SCHEMBL5497827 0.92 NAAA (0.47) NAAACYP1A2EPHX1SIGMAR1EPHX2
SCHEMBL23501850 0.81 NAAA (0.38) NAAACYP1A2EPHX1
SCHEMBL5726449 0.80 CYP1A2 (0.50) CYP1A2MEN1KMT2ASIGMAR1
SCHEMBL17731022 0.78 NAAA (0.46) NAAACYP1A2MEN1KMT2ATDP1
SCHEMBL3417077 0.77 CYP1A2 (0.44) NAAACYP1A2MEN1KMT2AEPHX1
SCHEMBL797981 0.77 NAAA (0.53) NAAAMEN1KMT2ATDP1L3MBTL1
SCHEMBL30835526 0.77 NAAA (0.44) NAAACYP1A2MEN1KMT2ATDP1
SCHEMBL3045540 0.76 CYP1A2 (0.50) NAAACYP1A2MEN1KMT2ASIGMAR1
SCHEMBL11126950 0.76 NAAA (0.43) NAAACYP1A2MEN1KMT2AEPHX1

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
EP-3066065-A1 CATALYTIC HYDROGENATION FOR PRODUCING AMINES FROM CARBOXYLIC ACID AMIDES, CARBOXYLIC ACID DIAMIDES, DI-, TRI-, OR POLYPEPETIDES, OR PEPTIDE AMIDES Evonik Degussa GmbH (DE) 2016-09-14 EP disclosed
US-9388338-B2 Liquid crystal mixture MERCK PATENT GMBH (DE) 2016-07-12 US disclosed
WO-2015067450-A1 CATALYTIC HYDROGENATION FOR PRODUCING AMINES FROM CARBOXYLIC ACID AMIDES, CARBOXYLIC ACID DIAMIDES, DI-, TRI-, OR POLYPEPETIDES, OR PEPTIDE AMIDES EVONIK INDUSTRIES AG (DE) 2015-05-14 WO disclosed
US-20060011886-A1 Liquid crystal mixture LI JI 2006-01-19 US disclosed
US-6958176-B2 Liquid crystal mixture AZ ELECTRONIC MATERIALS (GERMANY) GMBH (DE) 2005-10-25 US disclosed
EP-1319054-B1 LIQUID CRYSTAL MIXTURE CLARIANT INT LTD (CH) 2005-03-16 EP disclosed
US-20040085490-A1 Liquid crystal mixture AZ ELECTRONIC MATERIALS (GERMANY) GMBH (DE) 2004-05-06 US disclosed
EP-1319054-A1 LIQUID CRYSTAL MIXTURE CLARIANT INTERNATIONAL LTD. (CH) 2003-06-18 EP disclosed
WO-2002018515-A1 LIQUID CRYSTAL MIXTURE CLARIANT INTERNATIONAL LTD. (DE) 2002-03-07 WO disclosed
EP-1184442-A1 Liquid crystal mixture Clariant International Ltd. (CH) 2002-03-06 EP disclosed