SCHEMBL446167

SCHEMBL446167

O=C(N1CCCCC1)N1CCCCC1

nearest known ligand 0.93

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 8/20 0.93
CA2 P00918 1/20 0.70
CHKA P35790 1/20 0.70
KMT2A Q03164 3/20 0.61
MEN1 O00255 2/20 0.61
TP53 P04637 1/20 0.55
HSD11B1 P28845 1/20 0.52
USP2 O75604 1/20 0.52
HPGD P15428 4/20 0.50
MMP1 P03956 1/20 0.50
MMP2 P08253 1/20 0.50
MMP3 P08254 1/20 0.50
MMP9 P14780 1/20 0.50
SMN1; SMN2 Q16637 2/20 0.48
LMNA P02545 1/20 0.48
AKR1C3 P42330 1/20 0.48
HTT P42858 1/20 0.48
POLB P06746 1/20 0.47
KDM4E B2RXH2 1/20 0.47
MAPT P10636 1/20 0.47

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
SCHEMBL3948862 1.00 ALDH1A1 (0.93) ALDH1A1CA2CHKAKMT2AMEN1
SCHEMBL3947402 1.00 ALDH1A1 (0.93) ALDH1A1CA2CHKAKMT2AMEN1
SCHEMBL2323473 1.00 ALDH1A1 (0.93) ALDH1A1CA2CHKAKMT2AMEN1
SCHEMBL3948090 1.00 ALDH1A1 (0.93) ALDH1A1CA2CHKAKMT2AMEN1
SCHEMBL3947407 1.00 ALDH1A1 (0.93) ALDH1A1CA2CHKAKMT2AMEN1
SCHEMBL733597 1.00 ALDH1A1 (0.93) ALDH1A1CA2CHKAKMT2AMEN1
SCHEMBL3948084 1.00 ALDH1A1 (0.93) ALDH1A1CA2CHKAKMT2AMEN1
SCHEMBL3949743 0.97 ALDH1A1 (0.94) ALDH1A1CA2CHKAKMT2AMEN1
SCHEMBL3947986 0.97 ALDH1A1 (0.94) ALDH1A1CA2CHKAKMT2AMEN1
SCHEMBL3947992 0.97 ALDH1A1 (0.94) ALDH1A1CA2CHKAKMT2AMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-106715422-B Indene derivative, preparation method and the pharmaceutical composition for being used to prevent or treat retinal disease comprising it as active constituent 忠南大学校产学协力团 2019-11-19 CN claimed
CN-110291087-A Tetrahydronaphthalene and tetrahydroisoquinoline derivatives as estrogen receptor degraders 阿尔维纳斯运营股份有限公司 2019-09-27 CN claimed
CN-106795179-B Kinase inhibitor 锦州奥鸿药业有限责任公司 2019-09-17 CN claimed
CN-106660955-B Cyclohexene derivative, preparation method and the pharmaceutical composition for being used to prevent or treat metabolic disease comprising it as active constituent 现代药品株式会社 2019-08-23 CN claimed
CN-109942537-A A kind of ALDH2 agonist, preparation method and its usage 中国人民解放军第二军医大学 2019-06-28 CN claimed
CN-109942553-A A kind of synthesis of tri- substituted-tetrahydro 2H- pyran-2-one compound of chirality 3,4,6- and its method for transformation 大连理工大学 2019-06-28 CN claimed
CN-105980365-B Benzimidazol-2-amines as mIDH1 inhibitors 拜耳医药股份公司 2019-06-21 CN claimed
CN-109789645-A Method for producing reinforced polyamides by extrusion 巴斯夫欧洲公司 2019-05-21 CN claimed
CN-106674086-B A kind of piperidones Alkaloid compound and its preparation method and application 西安交通大学 2019-04-12 CN claimed
CN-109310668-A Positive allosteric modulators of muscarinic acetylcholine receptor M4 范德比尔特大学 2019-02-05 CN claimed
US-6150341-A REACTING THE 5'OH GROUP OF VB12 OR AN ANALOGUE THEREOF WITH A BIFUNCTIONAL CARBONYL ELECTROPHILE TO FORM AN ACTIVE INTERMEDIATE, AND SUBSEQUENTLY REACTING THE INTERMEDIATE WITH A NUCLEOPHILIC SPACER MOLECULE TO YIELD VB12 DERIVATIVE BIOTCH AUSTRALIA PTY LIMITED (AU) 2000-11-21 US claimed
EP-0743573-B1 Method for obtaining image contrast migration imaging members XEROX CORP (US) 2000-09-06 EP claimed
WO-1999065930-A1 VITAMIN B12 DERIVATIVES AND METHODS FOR THEIR PREPARATION BIOTECH AUSTRALIA PTY. LIMITED (AU) 1999-12-23 WO claimed
US-5759727-A TONER IMAGE ON TRANSPARENT SUBSTRATE; MELT POLYMER BACKING XEROX CORPORATION (US) 1998-06-02 US claimed
EP-0743573-A2 Method for obtaining image contrast migration imaging members XEROX CORPORATION (US) 1996-11-20 EP claimed
EP-0743574-A2 Migration imaging members XEROX CORPORATION (US) 1996-11-20 EP claimed
US-5563014-A SOFTENABLE LAYER CONTAINIG PHOTOSENSITIVE MARKING MATERIAL; TRANSPARENTIZING AGENT XEROX CORPORATION (US) 1996-10-08 US claimed
US-5514505-A SELECTIVE TRANSPARENTIZATION OF PHOTOSENSITIVE MIGRATION MARKING PARTICLES EMBEDDED NEAR THE SURFACE OF A SOFTENABLE LAYER SUPPORTED BY AN ELECTROCONDUCTIVE SUBSTRATE XEROX CORPORATION (US) 1996-05-07 US claimed
EP-0414009-A2 Reduction of acidity of polyesters by melt reaction endcapping with dialkyloxalate BRIDGESTONE/FIRESTONE, INC. (US) 1991-02-27 EP claimed
US-4983691-A Reduction of acidity of polyesters by melt reaction endcapping with dialkyloxylate or tetraalkyl urea BRIDGESTONE/FIRESTONE, INC. (US) 1991-01-08 US claimed