SCHEMBL8204787

SCHEMBL8204787

O=C1c2ccccc2CN1C1CCN(C/C=C\CC2c3ccccc3-c3ccccc32)CC1

nearest known ligand 0.54

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ MTR Q99707 1/20 0.54
▸ SCN1A P35498 13/20 0.48
▸ SCN5A Q14524 13/20 0.48
▸ SCN9A Q15858 13/20 0.48
▸ NPY1R P25929 1/20 0.41
▸ NPY5R Q15761 1/20 0.41
▸ KDM5A P29375 1/20 0.38
▸ CRBN Q96SW2 1/20 0.38

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
SCHEMBL8204791 1.00 MTR (0.54) MTRSCN1ASCN5ASCN9ANPY1R
SCHEMBL8202592 0.81 MTR (0.64) MTRSCN1ASCN5ASCN9ANPY1R
SCHEMBL7237147 0.80 MTR (0.69) MTRSCN1ASCN5ASCN9ANPY1R
SCHEMBL7237153 0.80 MTR (0.69) MTRSCN1ASCN5ASCN9ANPY1R
SCHEMBL7238535 0.80 MTR (0.69) MTRSCN1ASCN5ASCN9ANPY1R
SCHEMBL8483204 0.78 MTR (0.45) MTRSCN1ASCN5ASCN9ANPY1R
SCHEMBL8191068 0.75 MTR (0.48) MTRSCN1ASCN5ASCN9ANPY1R
SCHEMBL8191064 0.75 MTR (0.48) MTRSCN1ASCN5ASCN9ANPY1R
SCHEMBL7244168 0.75 MTR (0.58) MTRSCN1ASCN5ASCN9ANPY1R
SCHEMBL6191353 0.73 MTR (0.66) MTRSCN1ASCN5ASCN9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6034098-A ATHEROSCLEROSIS BRISTOL-MYERS SQUIBB COMPANY (US) 2000-03-07 — — US claimed
EP-0643057-A1 Inhibitors of microsomal triglyceride transfer protein BRISTOL-MYERS SQUIBB COMPANY (US) 1995-03-15 — — EP claimed
US-6066650-A USEFUL FOR LOWERING SERUM LIPIDS AND TREATING ATHEROSCLEROSIS AND RELATED DISEASES BRISTOL-MYERS SQUIBB COMPANY (US) 2000-05-23 — — US disclosed
US-6034098-A ATHEROSCLEROSIS BRISTOL-MYERS SQUIBB COMPANY (US) 2000-03-07 — — US disclosed
EP-0643057-A1 Inhibitors of microsomal triglyceride transfer protein BRISTOL-MYERS SQUIBB COMPANY (US) 1995-03-15 — — EP disclosed
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