SCHEMBL9838215

SCHEMBL9838215

CCCCOc1ccc(C2OCC(CCC)CO2)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.43
MAOA P21397 2/20 0.43
MAOB P27338 2/20 0.43
LMNA P02545 2/20 0.43
CRBN Q96SW2 1/20 0.42
MAPK1 P28482 2/20 0.40
LTA4H P09960 2/20 0.40
ALDH1A1 P00352 2/20 0.40
CYP1A2 P05177 1/20 0.40
CHRM2 P08172 1/20 0.40
CHRM1 P11229 1/20 0.40
HTR2A P28223 1/20 0.40
SCN1A P35498 1/20 0.40
HTR2B P41595 1/20 0.40
KCNH2 Q12809 1/20 0.40
SCN2A Q99250 1/20 0.40
SIGMAR1 Q99720 1/20 0.40
SCN3A Q9NY46 1/20 0.40
HRH3 Q9Y5N1 1/20 0.40
RAB9A P51151 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
SCHEMBL9837950 0.93 LMNA (0.45) NPC1MAOAMAOBLMNACRBN
SCHEMBL9344620 0.92 CRBN (0.40) NPC1MAOAMAOBLMNACRBN
SCHEMBL9346012 0.92 CRBN (0.39) NPC1MAOAMAOBLMNACRBN
SCHEMBL9346429 0.91 LMNA (0.40) NPC1MAOAMAOBLMNACRBN
SCHEMBL9348876 0.91 LMNA (0.40) NPC1MAOAMAOBLMNACRBN
SCHEMBL9346067 0.90 LMNA (0.39) NPC1MAOAMAOBLMNACRBN
SCHEMBL9345716 0.90 LMNA (0.39) NPC1MAOAMAOBLMNACRBN
SCHEMBL9344573 0.90 LMNA (0.39) NPC1MAOAMAOBLMNACRBN
SCHEMBL9345732 0.90 LMNA (0.39) NPC1MAOAMAOBLMNACRBN
SCHEMBL10349590 0.89 NQO1 (0.44) NPC1MAOAMAOBLMNAMAPK1

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-5030383-A With low temperature dependence of threshold voltage MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 1991-07-09 US disclosed
EP-0258349-B1 ELECTRO-OPTICAL DISPLAY ELEMENT MERCK PATENT GmbH (DE) 1990-05-23 EP disclosed
US-4751017-A LIQUID CRYSTALS MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 1988-06-14 US disclosed
EP-0258349-A1 ELECTRO-OPTICAL DISPLAY ELEMENT. MERCK PATENT GMBH (DE) 1988-03-09 EP disclosed
US-4715984-A DIELECTRICS FOR ELECTROOPTICAL DISPLAY MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 1987-12-29 US disclosed
WO-1987005318-A1 ELECTRO-OPTICAL DISPLAY ELEMENT MERCK Patent Gesellschaft mit beschränkter Haftung (DE) 1987-09-11 WO disclosed
EP-0220254-A1 BENZONITRILES. MERCK PATENT GMBH (DE) 1987-05-06 EP disclosed
EP-0205503-A1 LIQUID CRYSTALLINE PHASE. MERCK PATENT GMBH (DE) 1986-12-30 EP disclosed
WO-1986006372-A1 BENZONITRILE MERCK Patent Gesellschaft mit beschränkter Haftung (DE) 1986-11-06 WO disclosed
WO-1986003769-A1 LIQUID CRYSTALLINE PHASE MERCK Patent Gesellschaft mit beschränkter Haftung (DE) 1986-07-03 WO disclosed