SCHEMBL7204684

SCHEMBL7204684

CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCc1ccccc1

nearest known ligand 0.81

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KCNH2 Q12809 1/20 0.71
SIGMAR1 Q99720 6/20 0.62
ESR1 P03372 2/20 0.61
ADRA2A P08913 2/20 0.61
ADORA3 P0DMS8 2/20 0.61
TACR2 P21452 2/20 0.61
SLC6A2 P23975 2/20 0.61
SLC6A4 P31645 2/20 0.61
SLC6A3 Q01959 2/20 0.61
HTR2A P28223 2/20 0.61
KDM4E B2RXH2 1/20 0.61
ALDH1A1 P00352 1/20 0.61
LMNA P02545 1/20 0.61
SHBG P04278 1/20 0.61
TP53 P04637 1/20 0.61
CYP3A4 P08684 1/20 0.61
HSPD1 P10809 1/20 0.61
ADRB3 P13945 1/20 0.61
HTR2C P28335 1/20 0.61
HSPE1 P61604 1/20 0.61

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
SCHEMBL8678547 1.00 KCNH2 (0.71) KCNH2SIGMAR1ESR1ADRA2AADORA3
SCHEMBL210629 1.00 KCNH2 (0.71) KCNH2SIGMAR1ESR1ADRA2AADORA3
SCHEMBL10995503 1.00 KCNH2 (0.71) KCNH2SIGMAR1ESR1ADRA2AADORA3
SCHEMBL133045 1.00 KCNH2 (0.71) KCNH2SIGMAR1ESR1ADRA2AADORA3
SCHEMBL57721 1.00 KCNH2 (0.71) KCNH2SIGMAR1ESR1ADRA2AADORA3
Decane SCHEMBL8740719 1.00 KCNH2 (0.71) KCNH2SIGMAR1ESR1ADRA2AADORA3
SCHEMBL175633 1.00 KCNH2 (0.71) KCNH2SIGMAR1ESR1ADRA2AADORA3
SCHEMBL4465463 1.00 KCNH2 (0.71) KCNH2SIGMAR1ESR1ADRA2AADORA3
SCHEMBL8678238 1.00 KCNH2 (0.71) KCNH2SIGMAR1ESR1ADRA2AADORA3
SCHEMBL11231313 1.00 KCNH2 (0.71) KCNH2SIGMAR1ESR1ADRA2AADORA3

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 10 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9581501-B2 Temperature control material NIGK CORPORATION (JP) 2017-02-28 US disclosed
US-20160290871-A1 TEMPERATURE CONTROL MATERIAL NIGK CORPORATION (JP) 2016-10-06 US disclosed
US-9145514-B2 Temperature management indicator and structure having the same attached NICHIYU GIKEN KOGYO CO., LTD. (JP) 2015-09-29 US disclosed
EP-2554961-A1 TEMPERATURE MANAGEMENT INDICATOR AND STRUCTURE HAVING THE SAME ATTACHED Nichiyu Giken Kogyo Co. Ltd. (JP) 2013-02-06 EP disclosed
US-20130014690-A1 TEMPERATURE MANAGEMENT INDICATOR AND STRUCTURE HAVING THE SAME ATTACHED NICHIYU GIKEN KOGYO CO., LTD. (JP) 2013-01-17 US disclosed
US-6602594-B2 Mixture of a granular or powdery heat-fusible substance and a granular or powdery dyestuff that can be diffused through dispersion or dissolution; indicators; microcapsules NICHIYU GIKEN KOGYO CO., LTD. (JP) 2003-08-05 US disclosed
US-20010044014-A1 Irreversible heat-sensitive composition NICHIYU GIKEN KOGYO CO., LTD. 2001-11-22 US disclosed
EP-1149880-A1 Irreversible heat-sensitive composition Nichiyu Giken Kogyo Co., Ltd. (JP) 2001-10-31 EP disclosed
US-6090508-A RECORDING AND ERASING METHOD UTILIZING REVERSIBLE CHANGES IN CRYSTALLINE STATE OF RECORDING LAYER COMPRISING OPTICAL ANISOTROPIC THIN-FILM-SHAPED CRYSTALS OF ORGANIC MATERIAL AS CAUSED BY APPLICATION OF THERMAL ENERGY THERETO RICOH COMPANY, LTD. (JP) 2000-07-18 US disclosed
US-5185194-A Heat-mode recording medium RICOH COMPANY, LTD. (JP) 1993-02-09 US disclosed