SCHEMBL8205287

SCHEMBL8205287

N[C@H]1CCCC[C@@H]1N1CCOCC1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 2/20 0.42
▸ HPGD P15428 1/20 0.42
▸ MCOLN3 Q8TDD5 2/20 0.38
▸ CRHBP P24387 1/20 0.38
▸ CRHR2 Q13324 1/20 0.38
▸ THRB P10828 1/20 0.38
▸ MEN1 O00255 1/20 0.38
▸ KMT2A Q03164 1/20 0.38
▸ SMN1; SMN2 Q16637 2/20 0.37
▸ KCNA5 P22460 2/20 0.36
▸ SCN5A Q14524 2/20 0.36
▸ SLC18A3 Q16572 2/20 0.33
▸ CYP2A13 Q16696 1/20 0.33
▸ L3MBTL3 Q96JM7 1/20 0.33
▸ L3MBTL1 Q9Y468 1/20 0.33
▸ MGLL Q99685 1/20 0.32
▸ TDP1 Q9NUW8 1/20 0.31
▸ MAPT P10636 2/20 0.31
▸ NPSR1 Q6W5P4 2/20 0.31
▸ KDM4E B2RXH2 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
SCHEMBL798263 1.00 ALDH1A1 (0.42) ALDH1A1HPGDMCOLN3CRHBPCRHR2
SCHEMBL3572313 0.96 ALDH1A1 (0.42) ALDH1A1HPGDMCOLN3CRHBPCRHR2
Hydrochloric Acid SCHEMBL30314584 0.94 ALDH1A1 (0.41) ALDH1A1HPGDMCOLN3CRHBPCRHR2
SCHEMBL3516822 0.86 ALDH1A1 (0.45) ALDH1A1HPGDMCOLN3CRHBPCRHR2
SCHEMBL11472496 0.81 MEN1 (0.45) THRBMEN1KMT2ASMN1; SMN2SLC18A3
SCHEMBL20096012 0.81 MEN1 (0.45) THRBMEN1KMT2ASMN1; SMN2SLC18A3
SCHEMBL6909004 0.81 MEN1 (0.45) THRBMEN1KMT2ASMN1; SMN2SLC18A3
SCHEMBL7343176 0.81 MEN1 (0.45) THRBMEN1KMT2ASMN1; SMN2SLC18A3
SCHEMBL14393808 0.81 MEN1 (0.45) THRBMEN1KMT2ASMN1; SMN2SLC18A3
SCHEMBL495718 0.81 MEN1 (0.45) THRBMEN1KMT2ASMN1; SMN2SLC18A3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2000051981-A1 AMINOCYCLOALKYL CINNAMIDE COMPOUNDS FOR ARRHYTHMIA AND AS ANALGESICS AND ANESTHETICS NORTRAN PHARMACEUTICALS INC. (CA) 2000-09-08 — — WO disclosed
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