SCHEMBL1816231

SCHEMBL1816231

Cc1ccc[c]c1C1CCCCC1

nearest known ligand 0.34

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 3/20 0.34
GRIN2D O15399 1/20 0.34
GRIN3B O60391 1/20 0.34
GRIN1 Q05586 1/20 0.34
GRIN2A Q12879 1/20 0.34
GRIN2B Q13224 1/20 0.34
GRIN2C Q14957 1/20 0.34
GRIN3A Q8TCU5 1/20 0.34
NPC1 O15118 1/20 0.33
RAB9A P51151 1/20 0.33
S1PR1 P21453 1/20 0.33
S1PR5 Q9H228 1/20 0.33
ALOX12 P18054 2/20 0.33
EPHX1 P07099 1/20 0.33
P2RX7 Q99572 2/20 0.32
HTR2C P28335 2/20 0.32
CYP11B2 P19099 1/20 0.32
LMNA P02545 2/20 0.31
GAA P10253 1/20 0.31

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
SCHEMBL1814519 0.98 HTR2C (0.32) SIGMAR1GRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL458991 0.90 HTR2C (0.34) HTR2C
SCHEMBL529103 0.78 PTGDR2 (0.36) CYP11B2
SCHEMBL9644212 0.78 PTGDR2 (0.36) CYP11B2
SCHEMBL3775713 0.78 KDM1A (0.33) SIGMAR1GRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL3762169 0.78 ESR2 (0.44) SIGMAR1GRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL3775753 0.78 ESR1 (0.41) HTR2C
SCHEMBL2724600 0.77 GRM2 (0.33) S1PR1S1PR5HTR2C
SCHEMBL8429568 0.77 LMNA (0.31) ALOX12HTR2CLMNAGAA
SCHEMBL961820 0.77 HDAC4 (0.40) NPC1RAB9ACYP11B2LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023052353-A1 ESTERS OF 5-METHYLHEX-2-ENOL AND THEIR USE AS AROMA CHEMICALS BASF SE (DE) 2023-04-06 WO disclosed
EP-2493906-A1 HETEROLEPTIC CARBENE COMPLEXES AND USE THEREOF IN ORGANIC ELECTRONICS BASF SE (DE) 2012-09-05 EP disclosed
WO-2011051404-A1 HETEROLEPTIC CARBENE COMPLEXES AND USE THEREOF IN ORGANIC ELECTRONICS BASF SE (DE) 2011-05-05 WO disclosed
EP-0176106-B1 N,N',N-TRIS((2,2,6,6-TETRAMETHYL-4-PIPERIDYL)TRIAZINYL)-UNDECANE TRIAMINES AS STABILIZERS FOR SYNTHETIC POLYMERS ADEKA ARGUS CHEMICAL CO., Ltd. (JP) 1990-11-22 EP disclosed
EP-0065655-B1 POLYMERIC LIGHT STABILIZERS HAVING AT LEAST ONE 2,2,6,6-TETRAALKYL PIPERIDYL GROUP AND SYNTHETIC RESIN COMPOSITIONS CONTAINING THE SAME ADEKA ARGUS CHEMICAL CO., Ltd. (JP) 1988-12-07 EP disclosed
EP-0118578-B1 POLYETHERS CONTAINING 2,2,6,6-TETRAMETHYL PIPERIDINYL CARBOXYLIC ACID ESTER GROUPS AND SYNTHETIC RESIN COMPOSITIONS ADEKA ARGUS CHEMICAL CO., Ltd. (JP) 1988-09-07 EP disclosed
EP-0095031-B1 N,N,N-TRIS(2,2,6,6,-TETRAMETHYL-4-PIPERIDONE KETAL)-1,3,5-TRIAZINES AND SYNTHETIC RESIN COMPOSITIONS ADEKA ARGUS CHEMICAL CO., Ltd. (JP) 1987-09-30 EP disclosed
EP-0095571-B1 POLYHYDRIC ALCOHOL ETHERS OF 2,2,6,6-TETRAMETHYL-4-PIPERIDONE KETALS AND SYNTHETIC RESIN COMPOSITIONS ADEKA ARGUS CHEMICAL CO., Ltd. (JP) 1987-09-23 EP disclosed
EP-0081235-B1 ALKYLTHIOPROPIONYL HYDRAZINO TRIAZINES AND SYNTHETIC RESIN COMPOSITIONS ADEKA ARGUS CHEMICAL CO., Ltd. (JP) 1987-04-15 EP disclosed
EP-0046161-B1 STABILIZED POLYVINYLHALIDE RESIN PHOENIX CHEMICAL CORPORATION (US) 1986-11-12 EP disclosed
EP-0058434-B1 N-2-HYDROXYPROPYL PIPERIDINES AND PROCESS FOR PREPARING THE SAME ADEKA ARGUS CHEMICAL CO., Ltd. (JP) 1985-06-19 EP disclosed
EP-0081688-B1 POLY(PIPERIDYLAMINE) ALKANES AND SYNTHETIC RESIN COMPOSITIONS STABILIZED THEREBY ADEKA ARGUS CHEMICAL CO., Ltd. (JP) 1985-05-29 EP disclosed
EP-0040286-B1 POLYVINYL HALIDE RESIN COMPOSITIONS CONTAINING 1,3 DICARBONYL COMPOUNDS PHOENIX CHEMICAL CORPORATION (US) 1985-01-16 EP disclosed