SCHEMBL127034

SCHEMBL127034

Fc1ccc(C2CCCCC2)cc1F

nearest known ligand 0.49

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ACMSD Q8TDX5 2/20 0.44
BACE1 P56817 1/20 0.43
EPHX2 P34913 1/20 0.42
HTR2A P28223 1/20 0.42
HTR2C P28335 1/20 0.42
HTR2B P41595 1/20 0.42
KMO O15229 1/20 0.42
HTR1D P28221 1/20 0.41
PDK2 Q15119 1/20 0.41
NPC1 O15118 1/20 0.40
RAB9A P51151 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
HSP90AA1 P07900 1/20 0.40
GAA P10253 1/20 0.40
MAPT P10636 1/20 0.40
KMT2A Q03164 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
CYP3A4 P08684 2/20 0.39
CYP2C9 P11712 1/20 0.39

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
SCHEMBL12917832 0.93 GRIA4 (0.43) ACMSDBACE1HTR2AHTR2CHTR2B
Bicarbonate SCHEMBL8988240 0.91 ACMSD (0.54) ACMSDEPHX2KMONPC1RAB9A
SCHEMBL29389392 0.89 HTR2A (0.46) HTR2AHTR2CHTR2BKMT2ATDP1
SCHEMBL808710 0.89 HTR2A (0.46) HTR2AHTR2CHTR2BKMT2ATDP1
SCHEMBL23366152 0.88 HTR2A (0.38) ACMSDBACE1EPHX2HTR2AHTR2C
SCHEMBL14525325 0.88 HTR2A (0.38) ACMSDBACE1EPHX2HTR2AHTR2C
Ammonia Solution, Strong SCHEMBL2142374 0.86 HTR2A (0.44) HTR2AHTR2CHTR2BKMT2ATDP1
SCHEMBL18411541 0.86 CYP3A4 (0.50) ACMSDBACE1EPHX2PDK2HSP90AA1
SCHEMBL8767567 0.86 HTR2A (0.39) ACMSDBACE1HTR2AHTR2CHTR2B
SCHEMBL10043342 0.85 ABCB1 (0.38) ACMSDBACE1EPHX2HTR2AHTR2C

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
US-20070148554-A1 Non-aqueous electrolytic solution and lithium secondary battery UBE INDUSTRIES, LTD. (JP) 2007-06-28 US claimed
JP-5255667-A None JP disclosed
CN-109952300-B 5-or 8-substituted imidazo [1,5-a ] pyridines 百济神州有限公司 2022-01-18 CN disclosed
EP-3095834-B9 LIQUID-CRYSTALLINE MEDIUM AND LIQUID-CRYSTAL DISPLAY COMPRISING THE SAME MERCK PATENT GMBH (DE) 2019-09-04 EP disclosed
EP-2960316-B1 LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE DAINIPPON INK & CHEMICALS (JP) 2018-06-06 EP disclosed
EP-2837670-B1 FLUOROBIPHENYL-CONTAINING COMPOSITION DAINIPPON INK & CHEMICALS (JP) 2017-09-27 EP disclosed
CN-101394847-B Cycloalkylamines as monoamine reuptake inhibitors 塞普拉柯公司 2017-05-24 CN disclosed
CN-105406122-A Secondary battery SONY CORP 2016-03-16 CN disclosed
CN-103237795-B Substituted oxadiazole compounds and their use as S1P1Use of agonists BRISTOL-MYERS SQUIBB CO. (US) 2015-10-21 CN disclosed
EP-2128149-B1 Tetrahydrofuran compound, liquid crystal composition and liquid crystal display device containing the liquid crystal composition JNC CORP (JP) 2013-07-24 EP disclosed
WO-2010089092-A1 LIQUID CRYSTALLINE MEDIUM AND LIQUID CRYSTAL DISPLAY MERCK PATENT GMBH (DE) 2010-08-12 WO disclosed
US-20080152998-A1 has an open circuit voltage in a fully charged state per a pair of the positive electrode and the negative electrode in the range of 4.25 V or more and not more than 6.00 V SONY CORPORATION (JP) 2008-06-26 US disclosed
US-20070148554-A1 Non-aqueous electrolytic solution and lithium secondary battery UBE INDUSTRIES, LTD. (JP) 2007-06-28 US disclosed
US-20070104895-A1 LIQUID CRYSTAL OPTICAL MODULATION ELEMENT AND OPTICAL HEAD DEVICE ASAHI GLASS COMPANY, LIMITED (JP) 2007-05-10 US disclosed
US-20070082271-A1 Non-aqueous electrolytic solution and lithium secondary battery UBE INDUSTRIES, LTD. (JP) 2007-04-12 US disclosed
EP-1691441-A1 NONAQUEOUS ELECTROLYTE SOLUTION AND LITHIUM SECONDARY BATTERY Ube Industries, Ltd. (JP) 2006-08-16 EP disclosed
JP-H05255667-A LIQUID CRYSTAL COMPOSITION G T C:KK 1993-10-05 JP disclosed
EP-0194879-B1 CYCLOHEXANE DERIVATIVE Chisso Corporation (JP) 1989-03-08 EP disclosed
US-4695398-A Cyclohexane derivative CHISSO CORPORATION (JP) 1987-09-22 US disclosed
EP-0194879-A1 Cyclohexane derivative Chisso Corporation (JP) 1986-09-17 EP disclosed