SCHEMBL651683

SCHEMBL651683

COC(=O)N(C)CCOc1ccc(/N=C2/NC(=O)/C(=C/c3cnc(NC(=O)C4CC4)s3)S2)c(C)c1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 7/20 0.40
LMNA P02545 1/20 0.40
NPSR1 Q6W5P4 5/20 0.38
RECQL P46063 1/20 0.38
TDP1 Q9NUW8 3/20 0.36
L3MBTL1 Q9Y468 3/20 0.36
MAPK1 P28482 1/20 0.36
HPGD P15428 3/20 0.35
POLB P06746 2/20 0.35
PTP4A3 O75365 1/20 0.34
ABL1 P00519 2/20 0.34
PTPN7 P35236 1/20 0.34
DUSP3 P51452 1/20 0.34
PTPN12 Q05209 1/20 0.34
PTPN22 Q9Y2R2 1/20 0.34
PLA2G1B P04054 1/20 0.33
APEX1 P27695 1/20 0.33
ATG4B Q9Y4P1 1/20 0.33
RNASEL Q05823 1/20 0.33
ALOX15 P16050 1/20 0.33

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
SCHEMBL652415 0.93 MAPT (0.41) MAPTLMNANPSR1RECQLTDP1
SCHEMBL653897 0.91 MAPT (0.40) MAPTLMNANPSR1RECQLTDP1
SCHEMBL653370 0.90 MAPT (0.40) MAPTLMNANPSR1RECQLTDP1
SCHEMBL10176547 0.88 MAPT (0.47) MAPTLMNANPSR1RECQLTDP1
SCHEMBL699657 0.87 MAPT (0.41) MAPTLMNANPSR1RECQLTDP1
SCHEMBL650770 0.87 MAPT (0.41) MAPTLMNANPSR1RECQLTDP1
SCHEMBL654745 0.87 MAPT (0.38) MAPTLMNANPSR1RECQLTDP1
SCHEMBL10176532 0.86 PTPN7 (0.44) MAPTLMNANPSR1RECQLTDP1
SCHEMBL10176434 0.86 HPGD (0.41) MAPTLMNANPSR1RECQLTDP1
SCHEMBL703259 0.86 MEN1 (0.38) MAPTL3MBTL1MAPK1HPGDPOLB

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 886 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-104003990-A Heterocyclic amine Hedgehog signal path inhibitor JIANGSU SIMCERE PHARM RES CO 2014-08-27 CN claimed
CN-101910168-B Tropane compounds EXELIXIS INC 2014-07-30 CN claimed
CN-103910736-A Dihydropyran pyrimidine derivatives and pharmaceutical application thereof JIANGSU SIMCERE PHARM RES CO 2014-07-09 CN claimed
CN-101896507-B Catalyst compounds and their use EXXONMOBIL CHEM PATENTS INC 2012-11-28 CN claimed
CN-102516184-A DPP-IV inhibitor including beta-amino group, preparation method thereof and pharmaceutical composition containing the same for preventing and treating a diabetes or an obesity DONG A PHARM CO LTD 2012-06-27 CN claimed
CN-102171210-A Imidazopyridin-2-one derivatives DAIICHI SANKYO CO LTD 2011-08-31 CN claimed
CN-102149676-A Mono-aryl aminotetralines HOFFMANN LA ROCHE 2011-08-10 CN claimed
CN-102037007-A Selective exosite inhibition of PAPP-A activity against IGFBP-4 UNIV AARHUS 2011-04-27 CN claimed
CN-101981013-A Tetrahydrophenanthridinones and tetrahydrocyclopentaquinolinones as PARP and tubulin polymerization inhibitors JANSSEN PHARMACEUTICA NV 2011-02-23 CN claimed
CN-101910168-A Tropane compounds EXELIXIS INC 2010-12-08 CN claimed
CN-1344718-A New phthalocyanine derivative and its application BIN YUEJING (CN) 2002-04-17 CN claimed
CN-1072237-C Polymerization catalyst for alkylene oxide and process for producing poly MITSUI TOATSU CHEMICALS (JP) 2001-10-03 CN claimed
CN-1265115-A Streptogramines, their prepn. and compsns. containing them RHONE POULENC RORER SA (FR) 2000-08-30 CN claimed
CN-1231668-A 2-heteroatom substituted cyclopentadienyl-containing metal complexes and olefin polymerization process DOW CHEMICAL CO (US) 1999-10-13 CN claimed
CN-1230187-A Bicyclic heteroaromatic compounds as protein tyrosine kinase inhibitors GLAXO GROUP LTD (GB) 1999-09-29 CN claimed
CN-1230190-A 3-heteroatom sustituted cyclopentadienyl-containing metal complexes and olefin polymerization process DOW CHEMICAL CO (US) 1999-09-29 CN claimed
CN-1169742-A Molding material and molded motor MATSUSHITA ELECTRIC IND C LTD (JP) 1998-01-07 CN claimed
CN-1151414-A Polymerization catalyst for alkylene oxide and process for producing poly MITSUI TOATSU CHEMICALS (JP) 1997-06-11 CN claimed
CN-1145068-A Substituted sulphonylaminocarbonyltriazolinones and their use as herbicides BAYER AG (DE) 1997-03-12 CN claimed
CN-1123546-A 4-arylisoindole analgesics ORTHO PHARMA CORP (US) 1996-05-29 CN claimed