SCHEMBL13665053

SCHEMBL13665053

COCCCN(C)C(=O)c1ccc2oc(C(=O)Nc3ccc(Cl)cn3)c(NC(=O)[C@H]3CC[C@H](C(=O)N(C)C)CC3)c2c1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SMN1; SMN2 Q16637 4/20 0.40
▸ F10 P00742 8/20 0.39
▸ MEN1 O00255 4/20 0.38
▸ KMT2A Q03164 4/20 0.38
▸ HSD17B10 Q99714 3/20 0.38
▸ MAPT P10636 2/20 0.38
▸ TSHR P16473 2/20 0.38
▸ LMNA P02545 2/20 0.38
▸ NPSR1 Q6W5P4 2/20 0.38
▸ DHODH Q02127 1/20 0.38
▸ ALDH1A1 P00352 3/20 0.37
▸ KDM4E B2RXH2 2/20 0.37
▸ ALOX15 P16050 2/20 0.37
▸ HPGD P15428 1/20 0.37
▸ HTT P42858 1/20 0.37
▸ KCNH2 Q12809 1/20 0.36
▸ GAA P10253 1/20 0.36
▸ NPC1 O15118 2/20 0.35
▸ RAB9A P51151 2/20 0.35
▸ NFKB1 P19838 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
SCHEMBL13664973 0.96 F10 (0.42) SMN1; SMN2F10MEN1KMT2AHSD17B10
SCHEMBL13665089 0.92 NPC1 (0.43) SMN1; SMN2MEN1KMT2AHSD17B10MAPT
SCHEMBL13664974 0.92 SMN1; SMN2 (0.42) SMN1; SMN2F10MEN1KMT2AHSD17B10
SCHEMBL13665052 0.91 HSD17B10 (0.40) SMN1; SMN2F10MEN1KMT2AHSD17B10
SCHEMBL13665054 0.90 F10 (0.40) SMN1; SMN2F10MEN1KMT2AHSD17B10
SCHEMBL13665055 0.89 SMN1; SMN2 (0.39) SMN1; SMN2F10MEN1KMT2AHSD17B10
SCHEMBL4325368 0.89 SMN1; SMN2 (0.46) SMN1; SMN2F10MEN1KMT2AHSD17B10
SCHEMBL13665086 0.88 NPC1 (0.44) SMN1; SMN2MEN1KMT2AHSD17B10MAPT
SCHEMBL4316221 0.88 SMN1; SMN2 (0.44) SMN1; SMN2F10MEN1KMT2AHSD17B10
SCHEMBL4316217 0.88 SMN1; SMN2 (0.44) SMN1; SMN2F10MEN1KMT2AHSD17B10

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