SCHEMBL8479385

SCHEMBL8479385

CCCCN(CC(F)(F)F)C(=O)C1c2cc(F)ccc2-c2ccc(F)c(N3CCC(N4Cc5ccccc5C4=O)CC3)c21

nearest known ligand 0.38

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ DPP4 P27487 1/20 0.38
▸ SCN1A P35498 10/20 0.35
▸ SCN5A Q14524 10/20 0.35
▸ SCN9A Q15858 10/20 0.35
▸ AOC3 Q16853 1/20 0.35
▸ NPY1R P25929 1/20 0.35
▸ NPY5R Q15761 1/20 0.35
▸ ALDH1A1 P00352 1/20 0.35
▸ MAPT P10636 1/20 0.35
▸ RORC P51449 1/20 0.34
▸ C5AR1 P21730 2/20 0.33
▸ MCHR1 Q99705 1/20 0.33
▸ F10 P00742 1/20 0.33

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
SCHEMBL8484431 0.89 L3MBTL1 (0.35) —
SCHEMBL8666043 0.87 HTT (0.33) C5AR1
SCHEMBL8479245 0.84 SCN1A (0.39) SCN1ASCN5ASCN9AAOC3NPY1R
SCHEMBL8504363 0.84 KCNA5 (0.30) —
SCHEMBL8664320 0.81 SCN1A (0.36) SCN1ASCN5ASCN9AAOC3NPY1R
SCHEMBL8479703 0.81 CCR3 (0.42) MCHR1
SCHEMBL8479389 0.81 DPP4 (0.38) DPP4SCN1ASCN5ASCN9AAOC3
SCHEMBL8484683 0.80 SCN1A (0.40) SCN1ASCN5ASCN9AAOC3NPY1R
SCHEMBL8480404 0.80 SCN1A (0.39) SCN1ASCN5ASCN9AAOC3NPY1R
SCHEMBL8487923 0.79 SCN1A (0.38) SCN1ASCN5ASCN9AAOC3NPY1R

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5883099-A TREATMENT OF ATHERSCLEROSIS, PANCREATITIS OBESITY OR HYPERGLYCEMIA BRISTOL-MYERS SQUIBB COMPANY (US) 1999-03-16 — — US disclosed
US-H1729-H Method for preparing compounds employing solid phase synthesis and novel linker-resin BRISTOL-MYERS SQUIBB COMPANY (US) 1998-05-05 — — US disclosed
US-5739135-A PREVENTING OR TREATING ATHEROSCLEROSIS, PANCREATITIS SECONDARY TO HYPERTRIGLYCERIDEMIA, HYPERGLYCEMIA, OBESITY BRISTOL-MYERS SQUIBB COMPANY (US) 1998-04-14 — — US disclosed
Send feedback