SCHEMBL13664984

SCHEMBL13664984

CN(C)CCN(C)C(=O)Cc1ccc2oc(C(=O)Nc3ccc(Cl)cn3)c(NC(=O)[C@H]3CC[C@H](C(=O)N(C)C)CC3)c2c1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SMN1; SMN2 Q16637 4/20 0.41
▸ HSD17B10 Q99714 4/20 0.38
▸ F10 P00742 8/20 0.38
▸ MEN1 O00255 5/20 0.36
▸ KMT2A Q03164 5/20 0.36
▸ KLKB1 P03952 2/20 0.36
▸ TP53 P04637 2/20 0.36
▸ MAPT P10636 4/20 0.35
▸ TSHR P16473 4/20 0.35
▸ LMNA P02545 2/20 0.35
▸ DHODH Q02127 1/20 0.35
▸ NPSR1 Q6W5P4 1/20 0.35
▸ KDM4E B2RXH2 3/20 0.35
▸ HPGD P15428 2/20 0.35
▸ NPC1 O15118 2/20 0.35
▸ ALDH1A1 P00352 1/20 0.35
▸ ALOX15 P16050 1/20 0.35
▸ HTT P42858 1/20 0.35
▸ CASP1 P29466 1/20 0.35
▸ POLB P06746 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
SCHEMBL13664983 0.93 F10 (0.40) SMN1; SMN2HSD17B10F10MEN1KMT2A
SCHEMBL13664980 0.93 SMN1; SMN2 (0.44) SMN1; SMN2HSD17B10F10MEN1KMT2A
SCHEMBL13665070 0.92 NPC1 (0.41) SMN1; SMN2HSD17B10MEN1KMT2ATP53
SCHEMBL13665055 0.92 SMN1; SMN2 (0.39) SMN1; SMN2HSD17B10F10MEN1KMT2A
SCHEMBL13665056 0.92 HSD17B10 (0.40) SMN1; SMN2HSD17B10F10MEN1KMT2A
SCHEMBL13664989 0.90 F10 (0.39) SMN1; SMN2HSD17B10F10MEN1KMT2A
SCHEMBL13664967 0.90 SMN1; SMN2 (0.44) SMN1; SMN2HSD17B10F10MEN1KMT2A
SCHEMBL13664974 0.88 SMN1; SMN2 (0.42) SMN1; SMN2HSD17B10F10MEN1KMT2A
SCHEMBL13665057 0.88 HSD17B10 (0.39) SMN1; SMN2HSD17B10F10MEN1KMT2A
SCHEMBL13664961 0.88 SMN1; SMN2 (0.43) SMN1; SMN2HSD17B10F10MEN1KMT2A

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