SCHEMBL10404490

SCHEMBL10404490

CC(=O)Oc1ccc(OCC=S)cc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 4/20 0.52
▸ MAPT P10636 4/20 0.47
▸ POLB P06746 2/20 0.47
▸ PKM P14618 1/20 0.47
▸ KDM4E B2RXH2 3/20 0.46
▸ MEN1 O00255 2/20 0.46
▸ KMT2A Q03164 2/20 0.46
▸ CYP3A4 P08684 2/20 0.46
▸ TTR P02766 1/20 0.46
▸ TP53 P04637 1/20 0.46
▸ SMN1; SMN2 Q16637 1/20 0.46
▸ ELANE P08246 1/20 0.46
▸ HSD17B10 Q99714 1/20 0.44
▸ GAA P10253 2/20 0.43
▸ ALDH1A1 P00352 1/20 0.43
▸ HSP90AA1 P07900 1/20 0.43
▸ GLA P06280 1/20 0.41
▸ HTT P42858 1/20 0.41
▸ ESR1 P03372 3/20 0.40
▸ SLC6A3 Q01959 2/20 0.40

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
SCHEMBL5049713 0.81 LMNA (0.52) LMNAMAPTPOLBPKMKDM4E
SCHEMBL10402899 0.78 LMNA (0.52) LMNAMAPTPOLBPKMKDM4E
SCHEMBL10538989 0.77 HSD17B10 (0.53) LMNAMAPTPOLBPKMKDM4E
SCHEMBL269329 0.77 LMNA (0.80) LMNAMAPTPOLBPKMKDM4E
SCHEMBL3234922 0.76 NQO1 (0.61) LMNAMAPTPOLBPKMMEN1
SCHEMBL14760365 0.75 LMNA (0.76) LMNAMAPTPOLBPKMKDM4E
Lithium SCHEMBL30522746 0.75 LMNA (0.76) LMNAMAPTPOLBPKMKDM4E
SCHEMBL12909783 0.75 LMNA (0.57) LMNAMAPTPOLBPKMKDM4E
SCHEMBL10404489 0.74 LMNA (0.52) LMNAMAPTPOLBPKMKDM4E
SCHEMBL10404020 0.74 LTA4H (0.47) LMNAMEN1KMT2AESR1SLC6A3

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-4914206-A ANTIBIOTICS TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1990-04-03 — — US disclosed
EP-0226896-A2 Lankacidin derivatives and production thereof Takeda Chemical Industries, Ltd. (JP) 1987-07-01 — — EP disclosed
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