SCHEMBL6534948

SCHEMBL6534948

CCCCC/C=C\C/C=C\C/C=C\C/C=C\CCCC(=O)NC(C)C

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 3/20 0.76
SMN1; SMN2 Q16637 1/20 0.76
KCNK3 O14649 1/20 0.76
ALDH1A1 P00352 1/20 0.76
THRB P10828 1/20 0.76
BLM P54132 1/20 0.76
TDP1 Q9NUW8 1/20 0.76
SLC6A5 Q9Y345 1/20 0.76
CNR1 P21554 1/20 0.69

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
SCHEMBL22758117 0.95 MEN1 (0.72) CNR2SMN1; SMN2KCNK3ALDH1A1THRB
SCHEMBL25847386 0.95 MEN1 (0.72) CNR2SMN1; SMN2KCNK3ALDH1A1THRB
SCHEMBL1456449 0.90 FAAH (0.79) CNR2SMN1; SMN2KCNK3ALDH1A1THRB
SCHEMBL1456866 0.90 FAAH (0.79) CNR2SMN1; SMN2KCNK3ALDH1A1THRB
SCHEMBL6903752 0.90 FAAH (0.79) CNR2SMN1; SMN2KCNK3ALDH1A1THRB
SCHEMBL5889532 0.89 CNR2 (0.74) CNR2SMN1; SMN2KCNK3ALDH1A1THRB
SCHEMBL375483 0.89 CNR2 (0.74) CNR2SMN1; SMN2KCNK3ALDH1A1THRB
SCHEMBL19557776 0.89 ALDH1A1 (0.60) CNR2SMN1; SMN2KCNK3ALDH1A1THRB
SCHEMBL14864043 0.88 CNR2 (0.81) CNR2SMN1; SMN2KCNK3ALDH1A1THRB
SCHEMBL3728695 0.86 SLC6A5 (1.00) CNR2SMN1; SMN2KCNK3ALDH1A1THRB

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
CN-109419789-B Compound for treating and/or preventing immune disorder diseases and application thereof 清华大学 2021-09-21 CN disclosed
CN-109420173-B Application of GPR55 and regulator thereof in preventing and treating immune system diseases 清华大学 2021-07-13 CN disclosed
CN-109420174-B Application of GPR18 and regulator thereof in preventing and treating immune system diseases 清华大学 2021-07-13 CN disclosed
CN-109419789-A Treatment and/or compound and its application of epidemic prevention disorders 清华大学 2019-03-05 CN disclosed
CN-109420174-A The application of GPR18 and its regulator in prevention and treatment disease of immune system 清华大学 2019-03-05 CN disclosed
CN-109420173-A The application of GPR55 and its regulator in prevention and treatment disease of immune system 清华大学 2019-03-05 CN disclosed
WO-2017053995-A1 CONJUGATED ANTISENSE COMPOUNDS AND THEIR USE IONIS PHARMACEUTICALS, INC. (US) 2017-03-30 WO disclosed
EP-1049474-A4 CANNABIMIMETIC LIPID AMIDES AS USEFUL MEDICATIONS UNIV CONNECTICUT (US) 2004-12-29 EP disclosed
EP-1049474-A1 CANNABIMIMETIC LIPID AMIDES AS USEFUL MEDICATIONS Makriyannis, Alexandros (US) 2000-11-08 EP disclosed
WO-2000032200-A1 CANNABIMIMETIC LIPID AMIDES AS USEFUL MEDICATIONS MAKRIYANNIS ALEXANDROS (US) 2000-06-08 WO disclosed