SCHEMBL17272

SCHEMBL17272

O=C(OCc1ccccc1)N1CCNCC1

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.66
KMT2A Q03164 1/20 0.66
NPSR1 Q6W5P4 1/20 0.66
SMN1; SMN2 Q16637 3/20 0.64
NPC1 O15118 3/20 0.64
RAB9A P51151 3/20 0.64
CYP2C19 P33261 1/20 0.61
SLC29A1 Q99808 1/20 0.56
HTR2C P28335 2/20 0.55
SIGMAR1 Q99720 2/20 0.51
L3MBTL1 Q9Y468 2/20 0.51
GRIN2B Q13224 4/20 0.51
HTT P42858 1/20 0.51
CYP2D6 P10635 1/20 0.50
CYP2C9 P11712 1/20 0.50
HTR1A P08908 1/20 0.48
ADRA2A P08913 1/20 0.48
ADRA2B P18089 1/20 0.48
ADRA2C P18825 1/20 0.48
DRD1 P21728 1/20 0.48

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
SCHEMBL3778880 1.00 MEN1 (0.66) MEN1KMT2ANPSR1SMN1; SMN2NPC1
SCHEMBL3889285 1.00 MEN1 (0.66) MEN1KMT2ANPSR1SMN1; SMN2NPC1
SCHEMBL18022826 0.98 MEN1 (0.64) MEN1KMT2ANPSR1SMN1; SMN2NPC1
SCHEMBL12391433 0.98 MEN1 (0.64) MEN1KMT2ANPSR1SMN1; SMN2NPC1
Hydrochloric Acid SCHEMBL31510126 0.98 MEN1 (0.64) MEN1KMT2ANPSR1SMN1; SMN2NPC1
SCHEMBL3970461 0.98 MEN1 (0.64) MEN1KMT2ANPSR1SMN1; SMN2NPC1
Hydrochloric Acid SCHEMBL5496481 0.98 MEN1 (0.64) MEN1KMT2ANPSR1SMN1; SMN2NPC1
SCHEMBL4588381 0.98 MEN1 (0.64) MEN1KMT2ANPSR1SMN1; SMN2NPC1
Potassium SCHEMBL31108362 0.98 MEN1 (0.64) MEN1KMT2ANPSR1SMN1; SMN2NPC1
Bromide SCHEMBL28246248 0.98 MEN1 (0.64) MEN1KMT2ANPSR1SMN1; SMN2NPC1

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

Appears in 3098 patents — a generic fragment claimed broadly, so it's down-weighted as IP noise. Top by claim status then date:

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2024137495-A9 FOSTEMSAVIR INTERMEDIATES AND PROCESS FOR THE PREPARATION THEREOF NAVINTA, LLC (US) 2024-07-25 WO claimed
US-20240208980-A1 Fostemsavir Intermediates and Process for the Preparation Thereof NAVINTA, LLC 2024-06-27 US claimed
WO-2024137495-A1 FOSTEMSAVIR INTERMEDIATES AND PROCESS FOR THE PREPARATION THEREOF NAVINTA, LLC (US) 2024-06-27 WO claimed
CN-113527270-B Medical intermediate of PROTAC molecule targeting monoacylglycerol lipase, preparation method and application 河南大学 2024-03-01 CN claimed
CN-116496295-A Synthesis method of stable isotope labeled levofloxacin 上海化工研究院有限公司 2023-07-28 CN claimed
CN-111303132-B Anticancer compound and preparation method and application thereof 辽宁孚音生物科技有限公司 2023-05-23 CN claimed
CN-111303132-A Anticancer compound and preparation method and application thereof 天津孚音生物科技发展有限公司 2020-06-19 CN claimed
CN-110845445-A Connecting body, preparation method and application thereof, and thalidomide-based PROTACs intermediate and application thereof 苏州爱玛特生物科技有限公司 2020-02-28 CN claimed
CN-110105309-A A kind of preparation method lying prostrate sulphur Xi Ting 山东京卫制药有限公司 2019-08-09 CN claimed
CN-110105308-A Preparation method of vortioxetine 山东京卫制药有限公司 2019-08-09 CN claimed
CN-1735599-A 1-propanol and 1-propylamine derivatives and their use as glucocorticoid ligands BOEHRINGER INGELHEIM PHARMA (US) 2006-02-15 CN claimed
US-6653295-B2 Protease inhibitor; viricide BRISTOL-MYERS SQUIBB COMPANY 2003-11-25 US claimed
US-20030064962-A1 Inhibitors of hepatitis C virus NS3 protease BRISTOL-MYERS SQUIBB COMPANY (FORMERLY D/B/A DUPONT PHARMACEUTICALS COMPANY) 2003-04-03 US claimed
EP-1071680-A4 N,N-DISUBSTITUTED AMIDES THAT INHIBIT THE BINDING OF INTEGRINS TO THEIR RECEPTORS TEXAS BIOTECHNOLOGY CORP (US) 2003-03-05 EP claimed
WO-2002048116-A2 INHIBITORS OF HEPATITIS C VIRUS NS3 PROTEASE BRISTOL-MYERS SQUIBB PHARMA COMPANY (US) 2002-06-20 WO claimed
US-6194448-B1 ANTIINFLAMMATORY AGENTS; ASTHMA; RHEUMATIC DISORDERS TEXAS BIOTECHNOLOGY CORPORATION 2001-02-27 US claimed
EP-1071680-A1 N,N-DISUBSTITUTED AMIDES THAT INHIBIT THE BINDING OF INTEGRINS TO THEIR RECEPTORS TEXAS BIOTECHNOLOGY CORPORATION (US) 2001-01-31 EP claimed
WO-1999052898-A1 N,N-DISUBSTITUTED AMIDES THAT INHIBIT THE BINDING OF INTEGRINS TO THEIR RECEPTORS TEXAS BIOTECHNOLOGY CORPORATION (US) 1999-10-21 WO claimed
EP-0296048-B1 DERIVATIVES OF PIPERAZINYL ALKYL PIPERAZINE DIONE, PROCESSES FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM ADIR ET COMPAGNIE (FR) 1991-11-21 EP claimed
EP-0296048-A1 Derivatives of piperazinyl alkyl piperazine dione, processes for their preparation and pharmaceutical compositions containing them ADIR ET COMPAGNIE (FR) 1988-12-21 EP claimed