Sugi Predict

Sugi Predict / Compounds / Benzodiazepine

Benzodiazepine

Benzodiazepine

SCHEMBL8530199

C1=Cc2ccccc2NN=C1.CCCCCCCCC

nearest known ligand 0.34

Full drug profile on Sugi Atlas →

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ GAA P10253 1/20 0.34
▸ MAPT P10636 1/20 0.34
▸ LIPG Q9Y5X9 1/20 0.33
▸ ALDH1A1 P00352 2/20 0.33
▸ CYP1A2 P05177 1/20 0.33
▸ CYP2D6 P10635 1/20 0.33
▸ CYP2C19 P33261 1/20 0.33
▸ KCNH2 Q12809 1/20 0.33
▸ SETD7 Q8WTS6 1/20 0.31
▸ GPR3 P46089 1/20 0.31
▸ NR1H2 P55055 1/20 0.31
▸ NR1H3 Q13133 1/20 0.31
▸ NPC1 O15118 1/20 0.31
▸ NAMPT P43490 2/20 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
Benzodiazepine SCHEMBL633678 0.87 GAA (0.36) GAAMAPT
Benzodiazepine SCHEMBL8137 0.86 GAA (0.44) GAAMAPT
Benzodiazepine SCHEMBL7160172 0.86 GAA (0.44) GAAMAPT
Benzodiazepine SCHEMBL27883058 0.84 GAA (0.40) GAAMAPT
Benzodiazepine SCHEMBL11809777 0.84 GAA (0.43) GAAMAPT
Benzodiazepine SCHEMBL936208 0.84 GAA (0.43) GAAMAPT
Benzodiazepine SCHEMBL6618830 0.84 GAA (0.43) GAAMAPT
Benzodiazepine SCHEMBL11474576 0.84 GAA (0.43) GAAMAPT
Benzodiazepine SCHEMBL4420872 0.84 GAA (0.43) GAAMAPT
Benzodiazepine SCHEMBL4700331 0.84 GAA (0.43) GAAMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5750353-A MESSENGER SIGNALS AND CHOLECYSTOKININS NEW ENGLAND MEDICAL CENTER HOSPITALS, INC. (US) 1998-05-12 — — US disclosed