SCHEMBL557630

SCHEMBL557630

CCN(CC)CCCC(C)O

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 2/20 0.41
LMNA P02545 1/20 0.36
TSHR P16473 1/20 0.36
CACNA2D1 P54289 6/20 0.36
PLA2G1B P04054 1/20 0.34
PLA2G2A P14555 1/20 0.34
NPSR1 Q6W5P4 1/20 0.34
PAOX Q6QHF9 1/20 0.33
HSP90AA1 P07900 1/20 0.33
HSP90AB1 P08238 1/20 0.33
CHRM2 P08172 2/20 0.33
CHRM3 P20309 2/20 0.33
CACNA1F O60840 1/20 0.33
ADRA2B P18089 1/20 0.33
ADRA2C P18825 1/20 0.33
HTR2A P28223 1/20 0.33
SLC6A4 P31645 1/20 0.33
DRD3 P35462 1/20 0.33
CACNA1D Q01668 1/20 0.33
KCNH2 Q12809 1/20 0.33

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
SCHEMBL29171486 0.91 SIGMAR1 (0.47) SIGMAR1TSHRCACNA2D1PLA2G1BPLA2G2A
SCHEMBL8518464 0.85 KCNH2 (0.47) PLA2G1BPLA2G2ACHRM2CHRM3CACNA1F
SCHEMBL1230110 0.84 TSHR (0.40) SIGMAR1TSHRPLA2G1BPLA2G2AALDH1A1
SCHEMBL3100521 0.83 CA12 (0.37) TSHRPLA2G1BPLA2G2ACHRM2CHRM3
SCHEMBL3112416 0.83 TSHR (0.35) TSHR
SCHEMBL8398889 0.83 CA12 (0.37) TSHRPLA2G1BPLA2G2ACHRM2CHRM3
Hydroxyamine SCHEMBL1454547 0.82 TSHR (0.38) SIGMAR1TSHRPLA2G1BPLA2G2ANPSR1
Bromide SCHEMBL28878835 0.82 TSHR (0.38) SIGMAR1TSHRPLA2G1BPLA2G2AALDH1A1
SCHEMBL1147030 0.82 SIGMAR1 (0.42) SIGMAR1LMNACACNA2D1PLA2G1BPLA2G2A
SCHEMBL441038 0.79 SIGMAR1 (0.43) SIGMAR1LMNACACNA2D1PLA2G1BPLA2G2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114933562-B Efficient preparation method of chloroquine based on (2-hydroxybenzyl) disubstituted phosphine oxide catalysis 华东理工大学 2024-07-23 CN claimed
CN-114933562-A Efficient preparation method of chloroquine based on catalysis of (2-hydroxybenzyl) disubstituted phosphine oxide 华东理工大学 2022-08-23 CN claimed
CN-109867790-B Organic silicon polyether copolymer and preparation method thereof 南京美思德新材料有限公司 2021-07-13 CN claimed
EP-1153052-B1 PROCESS FOR THE PREPARATION OF AN AQUEOUS DISPERSION OF AN ANIONIC POLYURETHANE FREE OF VOLATILE TERTIARY AMINES STAHL INT BV (NL) 2004-12-29 EP claimed
EP-1006140-B1 Process for the preparation of siloxane-oxyalkylene copolymers GEN ELECTRIC (US) 2004-07-14 EP claimed
US-6599977-B1 Process for the preparation of an aqueous dispersion of an anionic polyurethane. According to the invention, a tertiary amine functional urethane polymer or oligomer acts as acid neutralizing agent. The process with dispersion of anionic STAHL INTERNATIONAL B.V. (NL) 2003-07-29 US claimed
US-6372874-B1 SOLVENT-FREE HYDROSILATION OF UNSATURATED POLYETHERS WITH ORGANOHYDROGENSILOXANES IN THE PRESENCE OF HYDROXYL, CARBONYL, OR ETHER-FUNCTIONAL AMINES AS BUFFERS FOR THE METAL HYDROSILATION CATALYSTS; BY-PRODUCT INHIBITION; KINETICS CROMPTON CORPORATION 2002-04-16 US claimed
EP-1153052-A1 PROCESS FOR THE PREPARATION OF AN AQUEOUS DISPERSION OF AN ANIONIC POLYURETHANE FREE OF VOLATILE TERTIARY AMINES STAHL INTERNATIONAL B.V. (NL) 2001-11-14 EP claimed
WO-2001027179-A1 PROCESS FOR THE PREPARATION OF AN AQUEOUS DISPERSION OF AN ANIONIC POLYURETHANE FREE OF VOLATILE TERTIARY AMINES STAHL INTERNATIONAL B.V. (NL) 2001-04-19 WO claimed
EP-1006140-A2 Process for the preparation of siloxane-oxyalkylene copolymers CK WITCO CORPORATION (US) 2000-06-07 EP claimed
EP-0008411-B1 PROCESS FOR THE PREPARATION OF 5-DIETHYLAMINO-2-PENTANOL BASF Aktiengesellschaft (DE) 1982-01-27 EP claimed
US-4224251-A HYDROGENATION, ANHYDROUS CONDITIONS IN PRESENCE OF ALKALI OR ALKALINE EARTH COMPOUND BASF AKTIENGESELLSCHAFT (DE) 1980-09-23 US claimed
EP-4691607-A1 DRAW SOLUTE, DRAW SOLUTION, AND WATER TREATMENT METHOD Nippon Shokubai Co., Ltd. (JP) 2026-02-11 EP disclosed
US-12331218-B2 Waterborne light radiation polyurethane mixed polyester polymer coating system SOLARIS TECHNOLOGY LTD. (GB) 2025-06-17 US disclosed
WO-2024202660-A1 DRAW SOLUTE, DRAW SOLUTION, AND WATER TREATMENT METHOD 株式会社日本触媒 2024-10-03 WO disclosed
CN-114933562-B Efficient preparation method of chloroquine based on (2-hydroxybenzyl) disubstituted phosphine oxide catalysis 华东理工大学 2024-07-23 CN disclosed
US-4224251-A HYDROGENATION, ANHYDROUS CONDITIONS IN PRESENCE OF ALKALI OR ALKALINE EARTH COMPOUND BASF AKTIENGESELLSCHAFT (DE) 1980-09-23 US disclosed
EP-0008411-A1 Process for the preparation of 5-diethylamino-2-pentanol BASF Aktiengesellschaft (DE) 1980-03-05 EP disclosed
US-4072714-A NICKEL, COPPER, MANGANESE OXIDES AS CATALYST BASF AKTIENGESELLSCHAFT (DT) 1978-02-07 US disclosed
US-4048116-A NICKEL, COPPER, MANGANESE BASF AKTIENGESELLSCHAFT (DT) 1977-09-13 US disclosed