SCHEMBL1275476

SCHEMBL1275476

CNS(=O)(=O)CCc1ccc2[nH]ccc2c1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HDAC1 Q13547 1/20 0.48
▸ HDAC8 Q9BY41 1/20 0.48
▸ HTR1A P08908 2/20 0.47
▸ HTR1D P28221 2/20 0.47
▸ HTR1B P28222 2/20 0.47
▸ CYP19A1 P11511 1/20 0.46
▸ CYP17A1 P05093 1/20 0.40
▸ CYP11B1 P15538 1/20 0.40
▸ CYP11B2 P19099 1/20 0.40
▸ BPTF Q12830 1/20 0.40
▸ CA12 O43570 1/20 0.39
▸ CA1 P00915 1/20 0.39
▸ CA2 P00918 1/20 0.39
▸ CA9 Q16790 1/20 0.39
▸ HTR2A P28223 1/20 0.39
▸ HTR2C P28335 1/20 0.39
▸ HTR1E P28566 1/20 0.39
▸ HTR1F P30939 1/20 0.39
▸ HTR7 P34969 1/20 0.39
▸ HTR2B P41595 1/20 0.39

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
SCHEMBL5918472 0.85 CYP19A1 (0.55) HDAC1HDAC8HTR1AHTR1DHTR1B
SCHEMBL28853829 0.83 PTGS2 (0.53) HDAC1HDAC8CYP19A1CYP17A1CYP11B1
Sulfuric Acid SCHEMBL9705330 0.81 CYP19A1 (0.51) HDAC1HDAC8HTR1AHTR1DHTR1B
SCHEMBL9269708 0.80 HDAC1 (0.51) HDAC1HDAC8CYP19A1CYP17A1CYP11B1
SCHEMBL1650349 0.80 CA12 (0.49) HDAC1HDAC8CYP19A1CYP17A1CYP11B1
SCHEMBL9800386 0.79 HDAC1 (0.45) HDAC1HDAC8CYP19A1CYP17A1CYP11B1
SCHEMBL8666600 0.77 HDAC1 (0.55) HDAC1HDAC8CYP19A1CYP17A1CYP11B1
SCHEMBL9772878 0.77 HDAC1 (0.48) HDAC1HDAC8CYP19A1BPTFCA12
SCHEMBL14756111 0.76 SLC6A2 (0.51) HDAC1HDAC8CYP17A1CYP11B1CYP11B2
SCHEMBL1457933 0.75 CYP19A1 (0.48) HDAC1HDAC8HTR1AHTR1BCYP19A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2010004580-A2 PROCESS FOR PREPARING INDOLE DERIVATIVES IND-SWIFT LABORATORIES LIMITED (IN) 2010-01-14 — — WO claimed
WO-2009016466-A2 A PROCESS FOR THE PREPARATION OF NARATRIPTAN HYDROCHLORIDE ORCHID CHEMICALS & PHARMACEUTICALS LIMITED (IN) 2009-02-05 — — WO claimed
WO-2008072257-A2 PROCESS FOR THE PREPARATION OF INDOLE DERIVATIVES IND-SWIFT LABORATORIES LIMITED (IN) 2008-06-19 — — WO claimed
WO-2008056378-A2 NOVEL PROCESS FOR THE PREPARATION OF NARATRIPTAN HYDROCHLORIDE NATCO PHARMA LIMITED (IN) 2008-05-15 — — WO claimed
CN-115611854-B New method for preparing naratriptan and derivatives thereof 天津师范大学 2024-03-26 — — CN disclosed
CN-115611854-A New method for preparing naratriptan and derivatives thereof 天津师范大学 2023-01-17 — — CN disclosed
CN-113754631-B Heteroaryl method of indole 中国科学院理化技术研究所 2022-08-30 — — CN disclosed
CN-113754631-A Heteroaryl method of indole 中国科学院理化技术研究所 2021-12-07 — — CN disclosed
US-8735589-B2 Process for the synthesis of naratriptan CIPLA LIMITED (IN) 2014-05-27 — — US disclosed
US-8735589-B2 Process for the synthesis of naratriptan CIPLA LIMITED (IN) 2014-05-27 — — US disclosed
US-8735589-B2 Process for the synthesis of naratriptan CIPLA LIMITED (IN) 2014-05-27 — — US disclosed
EP-2467373-B1 A PROCESS FOR THE SYNTHESIS OF NARATRIPTAN CIPLA LTD (IN) 2013-10-02 — — EP disclosed
WO-2008072257-A2 PROCESS FOR THE PREPARATION OF INDOLE DERIVATIVES IND-SWIFT LABORATORIES LIMITED (IN) 2008-06-19 — — WO disclosed
WO-2008056378-A2 NOVEL PROCESS FOR THE PREPARATION OF NARATRIPTAN HYDROCHLORIDE NATCO PHARMA LIMITED (IN) 2008-05-15 — — WO disclosed
WO-2008056378-A2 NOVEL PROCESS FOR THE PREPARATION OF NARATRIPTAN HYDROCHLORIDE NATCO PHARMA LIMITED (IN) 2008-05-15 — — WO disclosed
EP-0303507-B1 INDOLE DERIVATIVES GLAXO GROUP LTD (GB) 1993-07-28 — — EP disclosed
US-4997841-A Indole derivatives GLAXO GROUP LIMITED (GB) 1991-03-05 — — US disclosed
US-4994483-A 5-substituted-3-aminoalkyl indole derivatives for migraine GLAXO GROUP LIMITED (GB) 1991-02-19 — — US disclosed
EP-0303507-A2 Indole derivatives GLAXO GROUP LIMITED (GB) 1989-02-15 — — EP disclosed
CN-85104233-A Chemical compound — 1987-01-07 — — CN disclosed
Send feedback