SCHEMBL13664995

SCHEMBL13664995

CN(C)CCN(C)C(=O)[C@H]1CC[C@H](C(=O)Nc2c(C(=O)Nc3ccc(Cl)cn3)oc3ccccc23)CC1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SMN1; SMN2 Q16637 3/20 0.54
▸ KMT2A Q03164 6/20 0.51
▸ MEN1 O00255 5/20 0.51
▸ HSD17B10 Q99714 5/20 0.50
▸ MAPT P10636 6/20 0.48
▸ KDM4E B2RXH2 5/20 0.48
▸ TSHR P16473 5/20 0.48
▸ ALDH1A1 P00352 3/20 0.48
▸ POLB P06746 2/20 0.48
▸ RXFP1 Q9HBX9 2/20 0.48
▸ HTT P42858 2/20 0.48
▸ HPGD P15428 1/20 0.48
▸ ALOX15 P16050 1/20 0.48
▸ GAA P10253 1/20 0.47
▸ TP53 P04637 3/20 0.46
▸ LMNA P02545 1/20 0.46
▸ DHODH Q02127 1/20 0.46
▸ NPSR1 Q6W5P4 1/20 0.46
▸ NPC1 O15118 1/20 0.42
▸ CASP3 P42574 1/20 0.42

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
SCHEMBL13664998 0.94 SMN1; SMN2 (0.54) SMN1; SMN2KMT2AMEN1HSD17B10MAPT
SCHEMBL13665005 0.92 SMN1; SMN2 (0.52) SMN1; SMN2KMT2AMEN1HSD17B10MAPT
SCHEMBL13665001 0.92 SMN1; SMN2 (0.52) SMN1; SMN2KMT2AMEN1HSD17B10MAPT
SCHEMBL13290977 0.91 SMN1; SMN2 (0.44) SMN1; SMN2KMT2AMEN1HSD17B10MAPT
SCHEMBL4327128 0.90 SMN1; SMN2 (0.59) SMN1; SMN2KMT2AMEN1HSD17B10MAPT
SCHEMBL4327123 0.90 SMN1; SMN2 (0.59) SMN1; SMN2KMT2AMEN1HSD17B10MAPT
SCHEMBL13290737 0.90 SMN1; SMN2 (0.44) SMN1; SMN2KMT2AMEN1HSD17B10MAPT
SCHEMBL13664997 0.89 SMN1; SMN2 (0.56) SMN1; SMN2KMT2AMEN1HSD17B10MAPT
SCHEMBL2942642 0.87 SMN1; SMN2 (0.52) SMN1; SMN2KMT2AMEN1HSD17B10MAPT
SCHEMBL2942645 0.87 SMN1; SMN2 (0.52) SMN1; SMN2KMT2AMEN1HSD17B10MAPT

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
Send feedback