SCHEMBL7761407

SCHEMBL7761407

CC1CCN(CCOc2ccc(C(=O)Cl)cc2)C1

nearest known ligand 0.61

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 6/20 0.61
ALDH1A1 P00352 2/20 0.61
LMNA P02545 1/20 0.61
SIGMAR1 Q99720 1/20 0.56
HRH2 P25021 1/20 0.55
HRH1 P35367 1/20 0.55
ESR1 P03372 2/20 0.55
ESR2 Q92731 2/20 0.55
SMN1; SMN2 Q16637 1/20 0.54
HRH3 Q9Y5N1 6/20 0.54
DRD2 P14416 1/20 0.53
DRD3 P35462 1/20 0.53

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
SCHEMBL7760294 0.87 KDM4E (0.61) KDM4EALDH1A1LMNASIGMAR1HRH2
SCHEMBL12050600 0.82 HRH3 (0.60) KDM4EALDH1A1HRH2HRH1SMN1; SMN2
SCHEMBL22066893 0.80 HRH2 (0.65) KDM4EALDH1A1SIGMAR1HRH2HRH1
SCHEMBL5685572 0.79 PSMB1 (0.75) KDM4EHRH3
SCHEMBL15040819 0.79 KDM4E (0.62) KDM4EALDH1A1LMNASIGMAR1ESR1
SCHEMBL15040817 0.79 KDM4E (0.59) KDM4EALDH1A1LMNASIGMAR1HRH3
SCHEMBL15019276 0.79 KDM4E (0.59) KDM4EALDH1A1LMNASIGMAR1HRH3
SCHEMBL5779141 0.79 SIGMAR1 (0.63) KDM4EALDH1A1SIGMAR1HRH3
SCHEMBL15040812 0.79 KDM4E (0.59) KDM4EALDH1A1LMNASIGMAR1HRH3
Hydrochloric Acid SCHEMBL6174512 0.78 PSMB1 (0.73) KDM4EALDH1A1LMNASMN1; SMN2HRH3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0693488-B1 An improved process for preparing 3-(4-aminoethoxy-benzoyl)benzo beta -thiophenes LILLY CO ELI (US) 2001-09-19 EP disclosed
EP-0765321-B1 2-AMINO-3-AROYL-BENZO BETA THIOPHENES AND METHOD OF MAKING THE SAME LILLY CO ELI (US) 2001-04-18 EP disclosed
US-5994547-A Process for preparing benzo[b]thiophenes ELI LILLY AND COMPANY (US) 1999-11-30 US disclosed
EP-0764150-B1 PRODUCTION OF HYDROXYTHIOACETAMIDES AND USE THEREOF IN THE SYNTHESIS OF BENZOTHIOPHENES LILLY CO ELI (US) 1999-10-27 EP disclosed
EP-0875511-A1 Demethylation process for preparing benzo[b]thiophenes ELI LILLY AND COMPANY (US) 1998-11-04 EP disclosed
EP-0764150-A4 PRODUCTION OF HYDROXYTHIOACETAMIDES AND USE THEREOF IN THE SYNTHESIS OF BENZOTHIOPHENES LILLY CO ELI (US) 1997-09-10 EP disclosed
EP-0765321-A4 1997-05-02 EP disclosed
EP-0765321-A1 2-AMINO-3-AROYL-BENZO BETA THIOPHENES AND METHOD OF MAKING THE SAME ELI LILLY AND COMPANY (US) 1997-04-02 EP disclosed
EP-0764150-A1 PRODUCTION OF HYDROXYTHIOACETAMIDES AND USE THEREOF IN THE SYNTHESIS OF BENZOTHIOPHENES ELI LILLY AND COMPANY (US) 1997-03-26 EP disclosed
US-5554755-A 2-amino-3-aroyl-benzo[β]thiophenes and methods for preparing and using same to produce 6-hydroxy-2-(4-hydroxyphenyl)-3-[4-(2-aminoethoxy)-benzoyl]benzo[β]thiophenes ELI LILLY AND COMPANY (US) 1996-09-10 US disclosed
WO-1995034536-A1 PRODUCTION OF HYDROXYTHIOACETAMIDES AND USE THEREOF IN THE SYNTHESIS OF BENZOTHIOPHENES ELI LILLY AND COMPANY (US) 1995-12-21 WO disclosed
WO-1995034557-A1 2-AMINO-3-AROYL-BENZO[β]THIOPHENES AND METHOD OF MAKING THE SAME ELI LILLY AND COMPANY (US) 1995-12-21 WO disclosed
US-5466810-A 2-amino-3-aroyl-benzo[β]thiophenes and methods for preparing and using same to produce 6-hydroxy-2-(4-hydroxyphenyl)-3-[4-(2-aminoethoxy)-benzoyl]benzo[β]thiophenes ELI LILLY AND COMPANY (US) 1995-11-14 US disclosed
US-5420349-A 2-amino-3-aroyl-benzo[β]thiophenes and methods for preparing and using same to produce 6-hydroxy-2-(4-hydroxyphenyl)-3-]benzo[4-(2-aminoethoxy)-benzoyl[β]thiophenes ELI LILLY AND COMPANY (US) 1995-05-30 US disclosed
EP-0062504-B1 PROCESS FOR PREPARING 3-(4-AMINOETHOXYBENZOYL)BENZO(B)THIOPHENES ELI LILLY AND COMPANY (US) 1986-01-02 EP disclosed
EP-0062505-B1 A PROCESS FOR PREPARING ACYLATED BENZOTHIOPHENES ELI LILLY AND COMPANY (US) 1985-07-24 EP disclosed
US-4380635-A Synthesis of acylated benzothiophenes ELI LILLY AND COMPANY (US) 1983-04-19 US disclosed
US-4358593-A BY ACYLATION OF PROTECTED 6-HYDROXY,2-(4-HYDROXYPHENYL) BENZO (B)THIOPHENE USING A FRIEDEL CRAFTS CATALYSTS; HYDROLYSIS ELI LILLY AND COMPANY (US) 1982-11-09 US disclosed
EP-0062505-A1 A process for preparing acylated benzothiophenes ELI LILLY AND COMPANY (US) 1982-10-13 EP disclosed
EP-0062504-A1 Process for preparing 3-(4-aminoethoxybenzoyl)benzo(b)thiophenes ELI LILLY AND COMPANY (US) 1982-10-13 EP disclosed