SCHEMBL7297883

SCHEMBL7297883

O=C1CC2CCSc3sccc3C2=NN1

nearest known ligand 0.40

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PBRM1 Q86U86 1/20 0.40
PDE3A Q14432 7/20 0.36
PDE3B Q13370 6/20 0.36
HRH3 Q9Y5N1 2/20 0.35
KCNH2 Q12809 1/20 0.35
MAPK1 P28482 1/20 0.33
HTT P42858 4/20 0.32
ALDH1A1 P00352 2/20 0.32
NPC1 O15118 2/20 0.32
PPARG P37231 1/20 0.32
RAB9A P51151 1/20 0.32
NCOA2 Q15596 1/20 0.32
NCOA1 Q15788 1/20 0.32
NPSR1 Q6W5P4 1/20 0.31
HPGD P15428 1/20 0.31
PDE4B Q07343 1/20 0.31

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
SCHEMBL7378157 0.76 PDE3A (0.35) PBRM1PDE3APDE3BHRH3KCNH2
SCHEMBL10571135 0.73 PDE3A (0.38) PBRM1PDE3APDE3BHRH3KCNH2
SCHEMBL7298498 0.72 PDE3A (0.32) PDE3APDE3BHRH3KCNH2
SCHEMBL7289484 0.71 GPR119 (0.38) PBRM1PDE3APDE3BHRH3KCNH2
SCHEMBL7288859 0.70 PDE3A (0.39) PBRM1PDE3APDE3BHRH3KCNH2
SCHEMBL10585131 0.69 GALR3 (0.39) PDE3APDE3BHRH3KCNH2MAPK1
SCHEMBL7290309 0.69 ALDH1A1 (0.41) MAPK1HTTALDH1A1NPC1RAB9A
SCHEMBL7294824 0.67 PDE3B (0.50) PDE3APDE3BMAPK1ALDH1A1NPC1
SCHEMBL7292775 0.67 HRH3 (0.34) PDE3APDE3BHRH3KCNH2
SCHEMBL7286897 0.66 POLB (0.43) ALDH1A1NPC1RAB9APDE4B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0426018-B1 Thiophene compounds and their pharmaceutical uses YOSHITIOMI PHARMACEUTICAL IND (JP) 1997-08-27 EP disclosed
EP-0729960-A1 Thiophene compounds and their use as intermediates in the preparation of antianxiety drugs, hypnotics, antiepileptic drugs and nuotropics YOSHITOMI PHARMACEUTICAL INDUSTRIES, LTD. (JP) 1996-09-04 EP disclosed
US-5329016-A Antianxiety, hypnotic agents, antiepileptic agents or nootropics YOSHITOMI PHARMACEUTICAL INDUSTRIES, LTD. (JP) 1994-07-12 US disclosed
US-5175162-A Anxiolytic, antiepilepic agents YOSHITIOMI PHARMACEUTICAL INDUSTRIES LTD. (JP) 1992-12-29 US disclosed
EP-0426018-A2 Thiophene compounds and their pharmaceutical uses YOSHITIOMI PHARMACEUTICAL INDUSTRIES, LTD. (JP) 1991-05-08 EP disclosed