SCHEMBL13664997

SCHEMBL13664997

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

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SMN1; SMN2 Q16637 3/20 0.56
▸ HSD17B10 Q99714 5/20 0.54
▸ KMT2A Q03164 6/20 0.53
▸ MEN1 O00255 5/20 0.53
▸ MAPT P10636 6/20 0.50
▸ KDM4E B2RXH2 5/20 0.50
▸ TSHR P16473 5/20 0.50
▸ ALDH1A1 P00352 3/20 0.50
▸ TP53 P04637 3/20 0.50
▸ POLB P06746 2/20 0.50
▸ RXFP1 Q9HBX9 2/20 0.50
▸ HTT P42858 2/20 0.50
▸ HPGD P15428 1/20 0.50
▸ ALOX15 P16050 1/20 0.50
▸ GAA P10253 1/20 0.48
▸ LMNA P02545 1/20 0.48
▸ DHODH Q02127 1/20 0.48
▸ NPSR1 Q6W5P4 1/20 0.48
▸ NPC1 O15118 1/20 0.44
▸ CASP3 P42574 1/20 0.44

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
SCHEMBL4327128 0.91 SMN1; SMN2 (0.59) SMN1; SMN2HSD17B10KMT2AMEN1MAPT
SCHEMBL4327123 0.91 SMN1; SMN2 (0.59) SMN1; SMN2HSD17B10KMT2AMEN1MAPT
SCHEMBL13665009 0.90 SMN1; SMN2 (0.53) SMN1; SMN2HSD17B10KMT2AMEN1MAPT
SCHEMBL13664995 0.89 SMN1; SMN2 (0.54) SMN1; SMN2HSD17B10KMT2AMEN1MAPT
SCHEMBL13665005 0.88 SMN1; SMN2 (0.52) SMN1; SMN2HSD17B10KMT2AMEN1MAPT
SCHEMBL13664998 0.88 SMN1; SMN2 (0.54) SMN1; SMN2HSD17B10KMT2AMEN1MAPT
SCHEMBL13665011 0.87 SMN1; SMN2 (0.57) SMN1; SMN2HSD17B10KMT2AMEN1MAPT
SCHEMBL13744974 0.87 SMN1; SMN2 (0.57) SMN1; SMN2HSD17B10KMT2AMEN1MAPT
SCHEMBL2940128 0.87 SMN1; SMN2 (0.59) SMN1; SMN2HSD17B10KMT2AMEN1MAPT
SCHEMBL2940131 0.87 SMN1; SMN2 (0.59) SMN1; SMN2HSD17B10KMT2AMEN1MAPT

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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