SCHEMBL7796635

SCHEMBL7796635

CC(=O)c1c(N)ccc2c1Cc1ccccc1-2

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 7/20 0.50
NPC1 O15118 6/20 0.50
HTR2B P41595 3/20 0.43
HTR7 P34969 2/20 0.43
HTR2C P28335 2/20 0.43
CYP1A2 P05177 1/20 0.43
ADRA2A P08913 1/20 0.43
MAOA P21397 1/20 0.43
SLC6A2 P23975 1/20 0.43
SLC6A4 P31645 1/20 0.43
PNMT P11086 1/20 0.41
DRD2 P14416 1/20 0.41
ADRA1D P25100 1/20 0.41
HTR2A P28223 1/20 0.41
ADRA1A P35348 1/20 0.41
ADRA1B P35368 1/20 0.41
ALDH1A1 P00352 3/20 0.41
MAPT P10636 3/20 0.41
KDM4E B2RXH2 3/20 0.41
SMN1; SMN2 Q16637 2/20 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
SCHEMBL3704663 0.84 RAB9A (0.50) RAB9ANPC1HTR2BHTR7HTR2C
SCHEMBL7937330 0.83 RAB9A (0.51) RAB9ANPC1HTR2BHTR7HTR2C
SCHEMBL1608310 0.78 NPC1 (0.50) RAB9ANPC1HTR2BHTR7HTR2C
SCHEMBL30988358 0.78 NPC1 (0.47) RAB9ANPC1HTR2BHTR7HTR2C
SCHEMBL8469214 0.78 NPC1 (0.47) RAB9ANPC1HTR2BHTR7HTR2C
SCHEMBL28198779 0.75 PNMT (0.47) RAB9ANPC1HTR2BHTR7HTR2C
SCHEMBL3763958 0.75 PNMT (0.51) RAB9ANPC1HTR2BHTR7HTR2C
SCHEMBL30549083 0.75 RAB9A (0.43) RAB9ANPC1HTR2BHTR7HTR2C
SCHEMBL30297457 0.74 NPC1 (0.50) RAB9ANPC1HTR2BHTR7HTR2C
SCHEMBL87731 0.74 NPC1 (0.50) RAB9ANPC1HTR2BHTR7HTR2C

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
CN-101173272-B Cotton DNA in situ hybridization technique INST OF COTTON SCIENCES CHINESE ACADEMY OF AGRICULTURAL SCIENCES 2010-08-25 CN disclosed
CN-101173272-A Cotton DNA fibre hybridization in situ technique INST OF COTTON SCIENCES CHINES (CN) 2008-05-07 CN disclosed
CN-101148663-A Preparation for cotton DNA fibre by cutting and drainage method INST OF COTTON SCIENCES CHINES (CN) 2008-03-26 CN disclosed
EP-0835233-B1 COMPOSITION AND METHOD FOR STABILIZING RADIOLABELED ORGANIC COMPOUNDS NEN LIFE SCIENCE PROD INC (US) 2001-12-05 EP disclosed
US-5843396-A Method for stabilizing radiolabeled organic compounds by adding a separate stabilizing compound NEN LIFE SCIENCE PRODUCTS, INC. (US) 1998-12-01 US disclosed
EP-0835233-A1 COMPOSITION AND METHOD FOR STABILIZING RADIOLABELED ORGANIC COMPOUNDS E.I. DU PONT DE NEMOURS AND COMPANY (US) 1998-04-15 EP disclosed
US-5738836-A Composition for stabilizing radiolabeled organic compounds E. I. DU PONT DE NEMOURS AND COMPANY (US) 1998-04-14 US disclosed
WO-1997001520-A1 COMPOSITION AND METHOD FOR STABILIZING RADIOLABELED ORGANIC COMPOUNDS E.I. DU PONT DE NEMOURS AND COMPANY (US) 1997-01-16 WO disclosed
WO-1988006445-A1 PROSTAGLANDIN B1, MACROMOLECULES AS ANTI-INFLAMMATORY AGENTS REGELSON WILLIAM (US) 1988-09-07 WO disclosed
US-4411881-A Composition and method for stabilizing radiolabeled compounds using thiocarbonylated diethylenetriamines NEW ENGLAND NUCLEAR CORPORATION (US) 1983-10-25 US disclosed