SCHEMBL13664979

SCHEMBL13664979

CN(C)CCN(C)C(=O)c1ccc2oc(C(=O)Nc3ccc(Cl)cn3)c(NC(=O)[C@H]3CC[C@H](C(=O)N4CCCC4)CC3)c2c1

nearest known ligand 0.40

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ F10 P00742 11/20 0.40
▸ SMN1; SMN2 Q16637 1/20 0.40
▸ KCNH2 Q12809 3/20 0.37
▸ ABL1 P00519 3/20 0.36
▸ RIN1 Q13671 3/20 0.36
▸ HSD17B10 Q99714 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
SCHEMBL13664978 0.93 F10 (0.39) F10SMN1; SMN2KCNH2HSD17B10
SCHEMBL13664975 0.91 F10 (0.43) F10SMN1; SMN2KCNH2
SCHEMBL13664974 0.90 SMN1; SMN2 (0.42) F10SMN1; SMN2HSD17B10
SCHEMBL13664989 0.89 F10 (0.39) F10SMN1; SMN2HSD17B10
SCHEMBL13664966 0.87 F10 (0.43) F10SMN1; SMN2KCNH2
SCHEMBL13664976 0.87 GRM5 (0.46) F10SMN1; SMN2KCNH2
SCHEMBL13664960 0.86 F10 (0.43) F10SMN1; SMN2KCNH2HSD17B10
SCHEMBL4319944 0.86 F10 (0.44) F10SMN1; SMN2KCNH2ABL1
SCHEMBL13665075 0.85 F10 (0.42) F10SMN1; SMN2KCNH2
SCHEMBL13664985 0.84 F10 (0.42) F10SMN1; SMN2HSD17B10

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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