SCHEMBL641620

SCHEMBL641620

CCc1ccc(C)[n+](C)c1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TP53 P04637 2/20 0.40
CA2 P00918 1/20 0.40
TAAR1 Q96RJ0 1/20 0.39
CYP2A6 P11509 1/20 0.38
LPL P06858 1/20 0.38
LIPG Q9Y5X9 1/20 0.38
ALDH1A1 P00352 1/20 0.37
TSHR P16473 1/20 0.35
MAPK1 P28482 1/20 0.35
ATM Q13315 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
PLAU P00749 1/20 0.34
LMNA P02545 1/20 0.34
HPGD P15428 1/20 0.34
MGLL Q99685 2/20 0.33
PLK1 P53350 1/20 0.33
IDO1 P14902 1/20 0.33
TRPA1 O75762 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
Iodide SCHEMBL3862124 0.98 CA2 (0.39) TP53CA2TAAR1CYP2A6LPL
Hydrochloric Acid SCHEMBL11592858 0.98 CA2 (0.39) TP53CA2TAAR1CYP2A6LPL
SCHEMBL11770358 0.88 CA2 (0.41) TP53CA2LPLLIPGALDH1A1
SCHEMBL11770347 0.88 CA2 (0.46) TP53CA2ALDH1A1L3MBTL1SMN1; SMN2
SCHEMBL19458162 0.76 TP53 (0.40) TP53CA2TAAR1CYP2A6LPL
SCHEMBL16097835 0.74 CA2 (0.39) TP53CA2TAAR1CYP2A6LPL
SCHEMBL641259 0.74 CA2 (0.39) TP53CA2TAAR1CYP2A6LPL
SCHEMBL1842853 0.74 CA2 (0.43) TP53CA2TAAR1CYP2A6LPL
SCHEMBL2125249 0.74 CA2 (0.39) TP53CA2TAAR1CYP2A6LPL
SCHEMBL6089163 0.74 L3MBTL1 (0.50) TP53CA2TAAR1CYP2A6LPL

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2009142893-A2 METHODS AND COMPOSITIONS FOR THE DELIVERY OF BIOACTIVE COMPOUNDS THE UNIVERSITY OF NORTH CAROLINA AT CHAPEL HILL (US) 2009-11-26 WO claimed
EP-4703496-A1 ETCHING COMPOSITION COMPRISING AT LEAST ONE IONIC LIQUID AND AT LEAST ONE LACTAMIDE AND PROCESS FOR COATING PLASTIC SURFACES WITH METALS BY USING THE SAME BASF SE (DE) 2026-03-04 EP disclosed
US-12077631-B2 Bulk polymerisation of polyoxazolidone BASF SE (DE) 2024-09-03 US disclosed
CN-112424253-B Bulk polymerization of polyoxazolidinones 巴斯夫欧洲公司 2024-02-27 CN disclosed
EP-3232455-B1 NONAQUEOUS ELECTROLYTE SOLUTION FOR ELECTRIC DOUBLE LAYER CAPACITORS OTSUKA CHEMICAL CO LTD (JP) 2023-10-25 EP disclosed
EP-3824012-B1 BULK POLYMERISATION OF POLYOXAZOLIDONE BASF SE (DE) 2022-09-07 EP disclosed
CN-110300772-B Polyoxazolidinones and process for their preparation 巴斯夫欧洲公司 2022-04-26 CN disclosed
US-11180603-B2 Polyoxazolidones and production thereof BASF SE (DE) 2021-11-23 US disclosed
US-20210253782-A1 BULK POLYMERISATION OF POLYOXAZOLIDONE BASF SE (DE) 2021-08-19 US disclosed
EP-3824012-A1 BULK POLYMERISATION OF POLYOXAZOLIDONE BASF SE (DE) 2021-05-26 EP disclosed
EP-1966284-A1 SOLVENT SYSTEM BASED ON MOLTEN IONIC LIQUIDS, ITS PRODUCTION AND USE FOR PRODUCING REGENERATED CARBOHYDRATES BASF SE (DE) 2008-09-10 EP disclosed
US-20080164440-A1 Solubility of Cellulose in Ionic Liquids With Addition of Amino Bases BASF AKTIENGESELLSCHAFT (DE) 2008-07-10 US disclosed
EP-1893651-A2 SOLUBILITY OF CELLULOSE IN IONIC LIQUIDS WITH ADDITION OF AMINO BASES BASF SE (DE) 2008-03-05 EP disclosed
US-7338428-B2 Combinatorial fluorescent library based on the styryl scaffold NEW YORK UNIVERSITY (US) 2008-03-04 US disclosed
US-7338428-B2 Combinatorial fluorescent library based on the styryl scaffold NEW YORK UNIVERSITY (US) 2008-03-04 US disclosed
US-20080028777-A1 Novel Pairs Of Working Substances For Absorption Heat Pumps, Absorption Refrigeration Machines And Heat Transformers BASF AKTIENGESELLSCHAFT (DE) 2008-02-07 US disclosed
WO-2007076979-A1 SOLVENT SYSTEM BASED ON MOLTEN IONIC LIQUIDS, ITS PRODUCTION AND USE FOR PRODUCING REGENERATED CARBOHYDRATES BASF SE (DE) 2007-07-12 WO disclosed
EP-1753837-A1 NOVEL PAIRS OF WORKING SUBSTANCES FOR ABSORPTION HEAT PUMPS, ABSORPTION REFRIGERATION MACHINES AND HEAT TRANSFORMERS BASF AKTIENGESELLSCHAFT (DE) 2007-02-21 EP disclosed
WO-2006108861-A2 SOLUBILITY OF CELLULOSE IN IONIC LIQUIDS WITH ADDITION OF AMINO BASES BASF AKTIENGESELLSCHAFT (DE) 2006-10-19 WO disclosed
WO-2005113702-A1 NOVEL PAIRS OF WORKING SUBSTANCES FOR ABSORPTION HEAT PUMPS, ABSORPTION REFRIGERATION MACHINES AND HEAT TRANSFORMERS BASF AKTIENGESELLSCHAFT (DE) 2005-12-01 WO disclosed