SCHEMBL8484431

SCHEMBL8484431

CCCCN(CC(F)(F)F)C(=O)C1c2cc(F)ccc2-c2ccc(F)c(N3CCC(N4C(=O)c5ccccc5C4=O)CC3)c21

nearest known ligand 0.35

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ L3MBTL1 Q9Y468 2/20 0.35
▸ HTT P42858 1/20 0.35
▸ LMNA P02545 1/20 0.32
▸ MAPK1 P28482 1/20 0.32
▸ TSHR P16473 2/20 0.32
▸ KMT2A Q03164 1/20 0.32
▸ JAK2 O60674 1/20 0.30
▸ JAK3 P52333 1/20 0.30

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
SCHEMBL8666043 0.96 HTT (0.33) L3MBTL1HTTLMNAMAPK1JAK2
SCHEMBL8504363 0.93 KCNA5 (0.30) —
SCHEMBL8479385 0.89 DPP4 (0.38) —
SCHEMBL8479703 0.84 CCR3 (0.42) KMT2A
SCHEMBL8665212 0.81 CCR3 (0.39) —
SCHEMBL8484139 0.81 NTRK1 (0.36) —
SCHEMBL8500943 0.79 CCR3 (0.36) —
SCHEMBL8484436 0.79 L3MBTL1 (0.37) L3MBTL1HTTLMNAMAPK1TSHR
SCHEMBL8669574 0.79 KDM4D (0.36) —
SCHEMBL8666049 0.77 L3MBTL1 (0.34) L3MBTL1HTTLMNAMAPK1

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
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