SCHEMBL27424929

SCHEMBL27424929

CCCCc1ccccc1-c1ccccc1.[SiH4]

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 1/20 0.50
PPARA Q07869 3/20 0.47
PDCD1 Q15116 1/20 0.44
CD274 Q9NZQ7 1/20 0.44
CA12 O43570 1/20 0.44
CA1 P00915 1/20 0.44
CA2 P00918 1/20 0.44
CA7 P43166 1/20 0.44
CA9 Q16790 1/20 0.44
CA14 Q9ULX7 1/20 0.44
LIPG Q9Y5X9 1/20 0.43
KMT2A Q03164 1/20 0.43
NR1H2 P55055 1/20 0.42
NR1H3 Q13133 1/20 0.42
PSMB5 P28074 1/20 0.42
HSD11B1 P28845 1/20 0.41
FOLH1 Q04609 1/20 0.41
PTGER1 P34995 1/20 0.41
PTGER4 P35408 1/20 0.41
PTGER3 P43115 1/20 0.41

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
SCHEMBL367335 0.98 DPP4 (0.52) DPP4PPARAPDCD1CD274CA12
Ethane SCHEMBL1275986 0.96 DPP4 (0.50) DPP4PPARAPDCD1CD274CA12
Phosphine SCHEMBL27550721 0.96 DPP4 (0.50) DPP4PPARAPDCD1CD274CA12
SCHEMBL28825457 0.96 DPP4 (0.50) DPP4PPARAPDCD1CD274CA12
SCHEMBL12610868 0.94 PPARA (0.49) DPP4PPARAPDCD1CD274CA12
SCHEMBL15391163 0.94 PPARA (0.49) DPP4PPARAPDCD1CD274CA12
SCHEMBL28804323 0.94 PPARA (0.49) DPP4PPARAPDCD1CD274CA12
SCHEMBL27277466 0.92 DPP4 (0.47) DPP4PPARAPDCD1CD274CA12
SCHEMBL27835204 0.92 PPARA (0.48) DPP4PPARAPDCD1CD274CA12
Cyanide SCHEMBL28342491 0.92 DPP4 (0.47) DPP4PPARAPDCD1CD274CA12

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109104862-A 4, 9-dioxo-4, 9-dihydronaphtho [2,3-b ] furan-3-carboxamide derivatives and their use for the treatment of proliferative and infectious diseases 中央研究院 2018-12-28 CN disclosed
CN-101668738-B Pleuromutilin derivatives for the treatment of microbial mediated diseases NABRIVA THERAPEUTICS AG (AT) 2014-10-15 CN disclosed
CN-101759645-B P38 inhibitors and methods of use thereof ARRAY BIOPHARMA INC 2014-06-25 CN disclosed
CN-102459162-B Novel cyclopentane derivatives HOFFMANN LA ROCHE 2014-01-08 CN disclosed
CN-102803259-A 1H-Imidazo[4, 5-c]quinolinone compounds, useful for the treatment of proliferative diseases NOVARTIS AG 2012-11-28 CN disclosed
CN-102686587-A Azaindole glucokinase activators HOFFMANN LA ROCHE 2012-09-19 CN disclosed
CN-102574807-A Spiropiperidine compounds and their use in the treatment of diabetes LILLY CO ELI 2012-07-11 CN disclosed
CN-102574785-A Tetra-substituted heteroaryl compounds and their use as MDM2 and/or MDM4 modulators NOVARTIS AG 2012-07-11 CN disclosed
CN-102459162-A Novel cyclopentane derivatives HOFFMANN LA ROCHE 2012-05-16 CN disclosed
CN-1759118-B Diazepinoindole derivatives as kinase inhibitors PFIZER 2010-12-08 CN disclosed
CN-101668738-A Pleuromutilin derivatives for the treatment of microbial mediated diseases NABRIVA THERAPEUTICS AG 2010-03-10 CN disclosed
CN-100482639-C N-bisaryl- and N-aryl-cycloalkylidenyl-alpha-hydroxy-and alpha-alkoxy acid amides SYNGENTA PARTICIPATIONS AG (CH) 2009-04-29 CN disclosed
CN-100420688-C Pyrimido[4,5-d]pyrimidine derivatives with anticancer activity HOFFMANN LA ROCHE (CH) 2008-09-24 CN disclosed
CN-100376564-C Substituted heterocyclic benzoeycloalkenes and the use thereof as substances having analgesic effect GRUENENTHAL CHEMIE (DE) 2008-03-26 CN disclosed
CN-1759118-A Diazepinoindole derivatives as kinase inhibitors PFIZER (US) 2006-04-12 CN disclosed
CN-1711264-A Pyrimido[4,5-d]pyrimidine derivatives with anticancer activity HOFFMANN LA ROCHE (CH) 2005-12-21 CN disclosed
CN-1671651-A N-bisaryl- and N-aryl-cycloalkylidenyl-alpha-hydroxy-and alpha-alkoxy acid amides SYNGENTA PARTICIPATIONS AG (CH) 2005-09-21 CN disclosed
CN-1221743-A Substituted heterocyclic benzoeycloalkenes and the use thereof as substances having analgesic effect GRUENENTHAL CHEMIE (DE) 1999-07-07 CN disclosed
CN-1086825-A Three ring and tetracyclic compounds HOFFMANN LA ROCHE (CH) 1994-05-18 CN disclosed