SCHEMBL7339446

SCHEMBL7339446

NC(=S)N1N=CC=Cc2ccccc21

nearest known ligand 0.40

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.40
TSHR P16473 1/20 0.40
MAPK1 P28482 1/20 0.40
SCN4A P35499 1/20 0.40
SCN5A Q14524 1/20 0.40
SCN9A Q15858 1/20 0.40
P2RX4 Q99571 8/20 0.33
P2RX1 P51575 2/20 0.32
P2RX3 P56373 2/20 0.32
MEN1 O00255 1/20 0.31
NPC1 O15118 1/20 0.31
ALDH1A1 P00352 1/20 0.31
MAPT P10636 1/20 0.31
CASP3 P42574 1/20 0.31
KMT2A Q03164 1/20 0.31
SENP7 Q9BQF6 1/20 0.31
SENP6 Q9GZR1 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
SCHEMBL7334705 0.83 LMNA (0.51) LMNATSHRMAPK1SCN4ASCN5A
SCHEMBL5747843 0.81 LMNA (0.40) LMNATSHRMAPK1SCN4ASCN5A
SCHEMBL5068751 0.78 P2RX4 (0.42) LMNATSHRMAPK1SCN4ASCN5A
SCHEMBL2979170 0.77 P2RX4 (0.42) LMNATSHRMAPK1SCN4ASCN5A
SCHEMBL27285585 0.76 LMNA (0.40) LMNATSHRMAPK1SCN4ASCN5A
SCHEMBL15865153 0.76 LMNA (0.40) LMNATSHRMAPK1SCN4ASCN5A
SCHEMBL3100027 0.74 P2RX4 (0.54) LMNATSHRMAPK1SCN4ASCN5A
SCHEMBL11741313 0.73 P2RX4 (0.43) LMNATSHRMAPK1SCN4ASCN5A
SCHEMBL5806375 0.73 LMNA (0.37) LMNATSHRMAPK1SCN4ASCN5A
SCHEMBL1574266 0.73 LMNA (0.37) LMNATSHRMAPK1SCN4ASCN5A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5962450-A SEDATIVE HOFFMANN-LA ROCHE INC. (US) 1999-10-05 US disclosed
US-5885986-A CLEAVING, N-ALKYLATING AND REDUCING THE INTERMEDIATE FORMED BY REACTING AN OXAZOLYL AND THIAZOLYLIMIDAZOBENZO AND THIENODIAZEPINE DERIVATIVES WITH AMINE COMPOUNDS; USED AS ANXIOLYTIC AND ANTICONVULSANT OR SEDATIVE-HYPNOTIC AGENTS HOFFMANN-LA ROCHE INC. (US) 1999-03-23 US disclosed
EP-0790999-A1 OXAZOLYL- AND THIAZOLYLIMIDAZO-BENZO- AND THIENODIAZEPINES AND THEIR USE AS MEDICAMENTS F. HOFFMANN-LA ROCHE AG (CH) 1997-08-27 EP disclosed
WO-1996015129-A1 OXAZOLYL- AND THIAZOLYLIMIDAZO-BENZO- AND THIENODIAZEPINES AND THEIR USE AS MEDICAMENTS F. HOFFMANN-LA ROCHE AG (CH) 1996-05-23 WO disclosed
CN-1019492-B Process for preparing benzo-and thiazolo-imidazodiazepine * derivatives HOFFMANN LA ROCHE (CH) 1992-12-16 CN disclosed
CN-85101490-A IMIDAZODIAZEPINE DERIVATIVES 1987-01-24 CN disclosed