SCHEMBL1023064

SCHEMBL1023064

CCCCCCN(CCCCCC)C(=O)c1cccc(C)c1

nearest known ligand 0.67

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
HPGD P15428 2/20 0.67
TDP1 Q9NUW8 1/20 0.67
ALDH1A1 P00352 2/20 0.56
NPC1 O15118 1/20 0.52
TP53 P04637 1/20 0.52
GPX4 P36969 1/20 0.52
RAB9A P51151 1/20 0.52
PAX8 Q06710 1/20 0.52
TSHR P16473 1/20 0.47
RXFP1 Q9HBX9 1/20 0.47
LPAR1 Q92633 1/20 0.46
MAOA P21397 1/20 0.46
MAOB P27338 1/20 0.46
KMT2A Q03164 1/20 0.46
CA12 O43570 1/20 0.45
CA1 P00915 1/20 0.45
CA2 P00918 1/20 0.45
CA9 Q16790 1/20 0.45

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
SCHEMBL10456889 0.94 HPGD (0.71) HPGDTDP1ALDH1A1TSHRRXFP1
SCHEMBL10724585 0.91 HPGD (0.61) HPGDTDP1ALDH1A1TSHRMAOA
SCHEMBL2225313 0.88 HPGD (0.77) HPGDTDP1ALDH1A1TP53TSHR
SCHEMBL13930121 0.87 HPGD (0.75) HPGDTDP1ALDH1A1TP53RXFP1
SCHEMBL9632099 0.85 HPGD (0.56) HPGDTDP1ALDH1A1TSHRMAOA
SCHEMBL30317186 0.85 HPGD (0.56) HPGDALDH1A1TSHR
SCHEMBL2482695 0.85 HPGD (0.56) HPGDALDH1A1TSHR
SCHEMBL10722469 0.84 HPGD (0.69) HPGDTDP1ALDH1A1TP53TSHR
SCHEMBL9166637 0.84 HPGD (0.55) HPGDTDP1ALDH1A1TSHRMAOA
SCHEMBL11221195 0.84 HPGD (0.55) HPGDTDP1ALDH1A1TSHRMAOA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2079679-B1 METHOD FOR PRODUCING TERTIARY AMIDES OF ALKYLPHENYL CARBOXYLIC ACIDS CLARIANT FINANCE BVI LTD (VG) 2012-08-22 EP disclosed
US-8067635-B2 Method for producing tertiary amides of alkylphenyl carboxylic acids CLARIANT FINANCE (BVI) LIMITED (VG) 2011-11-29 US disclosed
US-20110089019-A1 Continuous Method For Producing Amides of Aromatic Carboxylic Acids CLARIANT FINANCE (BVI) LIMITED (VG) 2011-04-21 US disclosed
EP-2274269-A1 CONTINUOUS METHOD FOR PRODUCING AMIDES OF AROMATIC CARBOXYLIC ACIDS Clariant Finance (BVI) Limited (VG) 2011-01-19 EP disclosed
US-20100081843-A1 Method For Producing Tertiary Amides Of Alkylphenyl Carboxylic Acids Clariant Finacne (BVI) LImited 2010-04-01 US disclosed
WO-2009121484-A1 CONTINUOUS METHOD FOR PRODUCING AMIDES OF AROMATIC CARBOXYLIC ACIDS CLARIANT INTERNATIONAL LTD (CH) 2009-10-08 WO disclosed
EP-2079679-A1 METHOD FOR PRODUCING TERTIARY AMIDES OF ALKYLPHENYL CARBOXYLIC ACIDS Clariant Finance (BVI) Limited (VG) 2009-07-22 EP disclosed
WO-2008043494-A1 METHOD FOR PRODUCING TERTIARY AMIDES OF ALKYLPHENYL CARBOXYLIC ACIDS CLARIANT FINANCE (BVI) LIMITED (VG) 2008-04-17 WO disclosed
CN-1350427-A Method, apparatus and composition for inhibiting the human scent tracking ability of mosquitoes in an environmentally defined three-dimensional space BIOSENSORY INC (US) 2002-05-22 CN disclosed