SCHEMBL1478181

SCHEMBL1478181

C=CC(=O)OCC[N+](C)(C)CCCCCCCC

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 6/20 0.61
HPGD P15428 1/20 0.61
ALDH1A1 P00352 3/20 0.52
CYP3A4 P08684 1/20 0.52
HTT P42858 2/20 0.48
DNM1 Q05193 7/20 0.47
TP53 P04637 2/20 0.43
HIF1A Q16665 2/20 0.43
HSD17B10 Q99714 1/20 0.43
HCAR2 Q8TDS4 1/20 0.42
MLNR O43193 1/20 0.42
NR1I2 O75469 1/20 0.42
ESR1 P03372 1/20 0.42
NR3C1 P04150 1/20 0.42
PGR P06401 1/20 0.42
ADRB2 P07550 1/20 0.42
CHRM2 P08172 1/20 0.42
ADRB1 P08588 1/20 0.42
HTR1A P08908 1/20 0.42
ADRA2A P08913 1/20 0.42

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
SCHEMBL9482851 1.00 TSHR (0.61) TSHRHPGDALDH1A1CYP3A4HTT
SCHEMBL9485642 1.00 TSHR (0.61) TSHRHPGDALDH1A1CYP3A4HTT
SCHEMBL9480197 1.00 TSHR (0.61) TSHRHPGDALDH1A1CYP3A4HTT
SCHEMBL3704021 1.00 TSHR (0.61) TSHRHPGDALDH1A1CYP3A4HTT
SCHEMBL5693523 1.00 TSHR (0.61) TSHRHPGDALDH1A1CYP3A4HTT
SCHEMBL9480136 1.00 TSHR (0.61) TSHRHPGDALDH1A1CYP3A4HTT
SCHEMBL9481026 1.00 TSHR (0.61) TSHRHPGDALDH1A1CYP3A4HTT
SCHEMBL1476262 1.00 TSHR (0.61) TSHRHPGDALDH1A1CYP3A4HTT
Hydrochloric Acid SCHEMBL7619758 0.98 TSHR (0.59) TSHRHPGDALDH1A1CYP3A4HTT
Bromide SCHEMBL8196037 0.98 TSHR (0.59) TSHRHPGDALDH1A1CYP3A4HTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0049855-B1 CEPHALOSPORIN DERIVATIVES, PROCESS FOR THEIR PREPARATION, PHARMACEUTICAL COMPOSITIONS CONTAINING THEM AND INTERMEDIATES FOR THEIR PREPARATION F. HOFFMANN-LA ROCHE & CO. Aktiengesellschaft (CH) 1986-01-29 EP claimed
CN-117043136-A Fluorine-based ionic liquid and method for producing same 第一工业制药株式会社 2023-11-10 CN disclosed
WO-2023287067-A1 ANTIBACTERIAL COMPOUND 주식회사 엘지화학 2023-01-19 WO disclosed
US-11111392-B2 Optical device with antistatic property 3M INNOVATIVE PROPERTIES COMPANY (US) 2021-09-07 US disclosed
US-20180030281-A1 OPTICAL DEVICE WITH ANTISTATIC PROPERTY 3M INNOVATIVE PROPERTIES COMPANY 2018-02-01 US disclosed
EP-2493941-B1 OPTICAL DEVICE WITH ANTISTATIC PROPERTY 3M INNOVATIVE PROPERTIES CO (US) 2017-09-20 EP disclosed
US-20120288675-A1 OPTICAL DEVICE WITH ANTISTATIC PROPERTY 3M INNOVATIVE PROPERTIES COMPANY 2012-11-15 US disclosed
US-7914864-B2 self-adhesion latex comprising shell-core polymers used as substrate coatings; improved image quality HEWLETT-PACKARD DEVELOPMENT COMPANY, L.P. (US) 2011-03-29 US disclosed
EP-1319519-B1 Ink jet recording element and printing method EASTMAN KODAK CO (US) 2006-05-24 EP disclosed
WO-2005092633-A1 A SYSTEM AND A METHOD FOR FORMING A HEAT FUSIBLE MICROPOROUS INK RECEPTIVE COATING HEWLETT-PACKARD DEVELOPMENT COMPANY, L.P. (US) 2005-10-06 WO disclosed
US-20030064203-A1 Ink jet recording element EASTMAN KODAK COMPANY 2003-04-03 US disclosed
US-20020155260-A1 Ink jet recording element EASTMAN KODAK COMPANY 2002-10-24 US disclosed
US-6375320-B1 Ink jet printing method EASTMAN KODAK COMPANY 2002-04-23 US disclosed
EP-1138512-A1 Ink-jet image-receiving element containing encapsulated particles EASTMAN KODAK COMPANY (US) 2001-10-04 EP disclosed
EP-1132218-A1 Ink jet printing method EASTMAN KODAK COMPANY (US) 2001-09-12 EP disclosed
EP-1132217-A1 Ink-jet recording element containing coated particles EASTMAN KODAK COMPANY (US) 2001-09-12 EP disclosed
US-5270046-A Heparin bound anti-thrombotic material UBE INDUSTRIES, LTD. (JP) 1993-12-14 US disclosed
EP-0076131-B1 HUMIDITY SENSOR AND METHOD FOR PREPARING A HUMIDITY SENSOR Hitachi, Ltd. (JP) 1986-04-09 EP disclosed
US-4473813-A CROSSLINKED SILICONE RESIN HITACHI, LTD. (JP) 1984-09-25 US disclosed
EP-0076131-A1 Humidity sensor and method for preparing a humidity sensor Hitachi, Ltd. (JP) 1983-04-06 EP disclosed