SCHEMBL13664988

SCHEMBL13664988

COCCN(C)C(=O)Cc1ccc2oc(C(=O)Nc3ccc(Cl)cn3)c(NC(=O)[C@H]3CC[C@H](C(=O)N4CCCC4)CC3)c2c1

nearest known ligand 0.39

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ F10 P00742 10/20 0.39
▸ SMN1; SMN2 Q16637 2/20 0.38
▸ HSD17B10 Q99714 3/20 0.37
▸ TP53 P04637 1/20 0.36
▸ MEN1 O00255 3/20 0.36
▸ KMT2A Q03164 3/20 0.36
▸ MAPT P10636 2/20 0.36
▸ TSHR P16473 2/20 0.36
▸ LMNA P02545 1/20 0.36
▸ DHODH Q02127 1/20 0.36
▸ NPSR1 Q6W5P4 1/20 0.36
▸ KDM4E B2RXH2 1/20 0.36
▸ ALDH1A1 P00352 1/20 0.36
▸ HPGD P15428 1/20 0.36
▸ ALOX15 P16050 1/20 0.36
▸ HTT P42858 1/20 0.36
▸ KCNH2 Q12809 1/20 0.35

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
SCHEMBL13664989 0.93 F10 (0.39) F10SMN1; SMN2HSD17B10TP53MEN1
SCHEMBL13664985 0.91 F10 (0.42) F10SMN1; SMN2HSD17B10TP53MEN1
SCHEMBL13664983 0.91 F10 (0.40) F10SMN1; SMN2HSD17B10TP53MEN1
SCHEMBL13664978 0.89 F10 (0.39) F10SMN1; SMN2HSD17B10MEN1KMT2A
SCHEMBL13664959 0.89 F10 (0.42) F10SMN1; SMN2HSD17B10TP53MEN1
SCHEMBL4318166 0.87 F10 (0.42) F10SMN1; SMN2HSD17B10TP53MEN1
SCHEMBL13664986 0.87 F10 (0.42) F10SMN1; SMN2HSD17B10MEN1KMT2A
SCHEMBL4318170 0.87 F10 (0.42) F10SMN1; SMN2HSD17B10TP53MEN1
SCHEMBL13665055 0.87 SMN1; SMN2 (0.39) F10SMN1; SMN2HSD17B10TP53MEN1
SCHEMBL13665056 0.85 HSD17B10 (0.40) F10SMN1; SMN2HSD17B10TP53MEN1

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