SCHEMBL7383269

SCHEMBL7383269

CC(=O)OCCc1cc2c(s1)SCCc1cc(=O)n(-c3ccc(Cl)cc3)nc1-2

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.35
ALDH1A1 P00352 2/20 0.35
HPGD P15428 1/20 0.35
ALOX12 P18054 1/20 0.35
KMT2A Q03164 3/20 0.34
MEN1 O00255 1/20 0.34
MAPT P10636 4/20 0.33
KDM4E B2RXH2 2/20 0.33
MAPK1 P28482 1/20 0.32
HTT P42858 2/20 0.32
SMN1; SMN2 Q16637 2/20 0.32
NPSR1 Q6W5P4 1/20 0.32
HRH3 Q9Y5N1 1/20 0.32
AOC3 Q16853 2/20 0.31
MALT1 Q9UDY8 1/20 0.31
APP P05067 1/20 0.31
CASP1 P29466 1/20 0.31
CA1 P00915 1/20 0.31
CA2 P00918 1/20 0.31
CA4 P22748 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
SCHEMBL7377706 0.86 ALDH1A1 (0.39) LMNAALDH1A1HPGDALOX12KMT2A
SCHEMBL7374989 0.85 ALDH1A1 (0.37) LMNAALDH1A1HPGDALOX12KMT2A
SCHEMBL7289978 0.84 ALDH1A1 (0.35) LMNAALDH1A1HPGDALOX12KMT2A
SCHEMBL7289101 0.84 ALDH1A1 (0.40) LMNAALDH1A1HPGDALOX12KMT2A
SCHEMBL7300102 0.83 KMT2A (0.33) LMNAALDH1A1HPGDALOX12KMT2A
SCHEMBL7298597 0.82 GABRP (0.39) LMNAALDH1A1HPGDALOX12KMT2A
SCHEMBL7296693 0.79 ALDH1A1 (0.39) LMNAALDH1A1HPGDALOX12KMT2A
SCHEMBL7290034 0.78 LMNA (0.38) LMNAALDH1A1HPGDALOX12KMT2A
SCHEMBL7379199 0.77 ALDH1A1 (0.39) LMNAALDH1A1HPGDALOX12KMT2A
SCHEMBL7296550 0.75 ALDH1A1 (0.40) LMNAALDH1A1KMT2AMEN1MAPT

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 4 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