SCHEMBL1073223

SCHEMBL1073223

COC(=O)N[C@H]1CCc2nc(NC(C)=O)sc2C1

nearest known ligand 0.60

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.51
NPC1 O15118 1/20 0.50
RAB9A P51151 1/20 0.50
SMN1; SMN2 Q16637 1/20 0.50
GSK3B P49841 2/20 0.47
CSNK2A1 P68400 2/20 0.47

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
SCHEMBL3048550 1.00 TSHR (0.51) TSHRNPC1RAB9ASMN1; SMN2GSK3B
SCHEMBL12805601 1.00 TSHR (0.51) TSHRNPC1RAB9ASMN1; SMN2GSK3B
Hydrochloric Acid SCHEMBL3048549 0.99 TSHR (0.50) TSHRNPC1RAB9ASMN1; SMN2GSK3B
Hydrochloric Acid SCHEMBL1073222 0.99 TSHR (0.50) TSHRNPC1RAB9ASMN1; SMN2GSK3B
Hydrochloric Acid SCHEMBL12805598 0.99 TSHR (0.50) TSHRNPC1RAB9ASMN1; SMN2GSK3B
SCHEMBL7312903 0.90 NPC1 (0.54) NPC1RAB9ASMN1; SMN2GSK3BCSNK2A1
SCHEMBL12804717 0.88 GSK3B (0.55) NPC1RAB9ASMN1; SMN2GSK3BCSNK2A1
SCHEMBL1030470 0.88 GSK3B (0.55) NPC1RAB9ASMN1; SMN2GSK3BCSNK2A1
SCHEMBL1029349 0.88 GSK3B (0.55) NPC1RAB9ASMN1; SMN2GSK3BCSNK2A1
SCHEMBL3562146 0.87 NPC1 (0.52) NPC1RAB9ASMN1; SMN2GSK3BCSNK2A1

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
EP-2289885-A1 Intermediates for the preparation of pramipexole Dipharma Francis S.r.l. (IT) 2011-03-02 EP disclosed
EP-1730129-B1 INTERMEDIATES FOR THE PREPARATION OF PRAMIPEXOLE DIPHARMA FRANCIS SRL (IT) 2011-01-19 EP disclosed