SCHEMBL9686924

SCHEMBL9686924

CC(=O)NC=Cc1cccs1.[Ag]

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HCAR2 Q8TDS4 1/20 0.51
▸ LMNA P02545 6/20 0.50
▸ RAB9A P51151 3/20 0.48
▸ KMT2A Q03164 3/20 0.48
▸ MEN1 O00255 2/20 0.48
▸ ALDH1A1 P00352 2/20 0.48
▸ ATM Q13315 1/20 0.48
▸ SMN1; SMN2 Q16637 5/20 0.47
▸ HPGD P15428 2/20 0.47
▸ MAPT P10636 3/20 0.46
▸ NPC1 O15118 2/20 0.46
▸ HTT P42858 2/20 0.46
▸ TAS1R3 Q7RTX0 1/20 0.44
▸ TAS1R1 Q7RTX1 1/20 0.44
▸ NPSR1 Q6W5P4 1/20 0.44
▸ KDM4E B2RXH2 1/20 0.44
▸ PSMD14 O00487 1/20 0.44
▸ TP53 P04637 1/20 0.44
▸ GLA P06280 1/20 0.44
▸ MTNR1A P48039 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
SCHEMBL19435727 0.98 HCAR2 (0.53) HCAR2LMNARAB9AKMT2AMEN1
SCHEMBL19435724 0.98 HCAR2 (0.53) HCAR2LMNARAB9AKMT2AMEN1
SCHEMBL19435723 0.98 HCAR2 (0.53) HCAR2LMNARAB9AKMT2AMEN1
SCHEMBL4913015 0.74 RAB9A (0.56) HCAR2LMNARAB9AKMT2AMEN1
SCHEMBL4913013 0.74 RAB9A (0.56) HCAR2LMNARAB9AKMT2AMEN1
SCHEMBL1862223 0.74 HCAR2 (0.69) HCAR2LMNARAB9AKMT2AMEN1
SCHEMBL369705 0.74 HCAR2 (0.69) HCAR2LMNARAB9AKMT2AMEN1
Acetone SCHEMBL8093756 0.73 HCAR2 (0.67) HCAR2LMNARAB9AKMT2AMEN1
Acetone SCHEMBL8093753 0.73 HCAR2 (0.67) HCAR2LMNARAB9AKMT2AMEN1
SCHEMBL7207106 0.71 SMN1; SMN2 (0.43) HCAR2LMNARAB9AKMT2AMEN1

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0191989-B1 ANTIBIOTIC ISOXAZOLE DERIVATIVES, THEIR PRODUCTION AND USE Takeda Chemical Industries, Ltd. (JP) 1992-09-02 — — EP disclosed
US-4897489-A 2-/5-OXO-2-TETRAHYDROFURANY4-3-OXOISOXOL-IDINE TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1990-01-30 — — US disclosed
EP-0191989-A1 Antibiotic isoxazole derivatives, their production and use Takeda Chemical Industries, Ltd. (JP) 1986-08-27 — — EP disclosed
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