SCHEMBL13664981

SCHEMBL13664981

CN(C)C(=O)[C@H]1CC[C@H](C(=O)Nc2c(C(=O)Nc3ccc(Cl)cn3)oc3ccc(CC(=O)N4CCCC4)cc23)CC1

nearest known ligand 0.41

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ F10 P00742 8/20 0.41
▸ SMN1; SMN2 Q16637 2/20 0.41
▸ JAK1 P23458 3/20 0.39
▸ HSD17B10 Q99714 1/20 0.37
▸ MEN1 O00255 1/20 0.36
▸ KMT2A Q03164 1/20 0.36

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
SCHEMBL13664982 0.94 JAK1 (0.41) F10SMN1; SMN2JAK1HSD17B10KMT2A
SCHEMBL13665067 0.92 NPC1 (0.41) SMN1; SMN2JAK1HSD17B10MEN1KMT2A
SCHEMBL13664986 0.92 F10 (0.42) F10SMN1; SMN2JAK1HSD17B10MEN1
SCHEMBL13664967 0.90 SMN1; SMN2 (0.44) F10SMN1; SMN2HSD17B10MEN1KMT2A
SCHEMBL13664980 0.90 SMN1; SMN2 (0.44) F10SMN1; SMN2JAK1HSD17B10MEN1
SCHEMBL13664985 0.89 F10 (0.42) F10SMN1; SMN2JAK1HSD17B10MEN1
SCHEMBL13664987 0.89 JAK1 (0.42) F10SMN1; SMN2JAK1KMT2A
SCHEMBL13664961 0.88 SMN1; SMN2 (0.43) F10SMN1; SMN2HSD17B10MEN1KMT2A
SCHEMBL13664971 0.88 F10 (0.42) F10SMN1; SMN2
SCHEMBL13664992 0.87 SMN1; SMN2 (0.44) F10SMN1; SMN2HSD17B10MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7605158-B2 Carbamoyl-type benzofuran derivatives MITSUBISHI TANABE PHARMA CORPORATION (JP) 2009-10-20 — — US disclosed
US-7605158-B2 Carbamoyl-type benzofuran derivatives MITSUBISHI TANABE PHARMA CORPORATION (JP) 2009-10-20 — — US disclosed
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