SCHEMBL9124649

SCHEMBL9124649

O=C(NC1N=C(c2ccccc2)c2ccccc2N(Cc2ccccc2)C1=O)c1cc2ccccc2[nH]1

nearest known ligand 0.82

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CCKBR P32239 14/20 0.82
CCKAR P32238 11/20 0.82
ADRB2 P07550 1/20 0.74
TSPO P30536 1/20 0.74
GLP1R P43220 1/20 0.74
FFAR4 Q5NUL3 1/20 0.74
PDE4A P27815 3/20 0.61
PDE4B Q07343 3/20 0.61
PDE4C Q08493 3/20 0.61
PDE4D Q08499 3/20 0.61
PDE5A O76074 2/20 0.61
PDE1A P54750 2/20 0.61
PDE1B Q01064 2/20 0.61
PDE1C Q14123 2/20 0.61
SENP1 Q9P0U3 2/20 0.50

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
SCHEMBL9124657 1.00 CCKBR (0.82) CCKBRCCKARADRB2TSPOGLP1R
SCHEMBL9126414 0.92 CCKBR (0.75) CCKBRCCKARADRB2TSPOGLP1R
SCHEMBL9125278 0.90 CCKBR (1.00) CCKBRCCKARADRB2TSPOGLP1R
SCHEMBL9125285 0.90 CCKBR (1.00) CCKBRCCKARADRB2TSPOGLP1R
SCHEMBL9124795 0.89 CCKBR (0.82) CCKBRCCKARADRB2TSPOGLP1R
SCHEMBL9126939 0.89 CCKBR (0.82) CCKBRCCKARADRB2TSPOGLP1R
SCHEMBL9126932 0.89 CCKBR (0.82) CCKBRCCKARADRB2TSPOGLP1R
SCHEMBL9124789 0.89 CCKBR (0.82) CCKBRCCKARADRB2TSPOGLP1R
SCHEMBL9459250 0.89 CCKBR (0.82) CCKBRCCKARADRB2TSPOGLP1R
SCHEMBL9123511 0.89 CCKBR (0.76) CCKBRCCKARADRB2TSPOGLP1R

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
US-5382664-A Benzodiazepine derivatives FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1995-01-17 US disclosed
US-5264433-A Benzodiazepine derivatives FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1993-11-23 US disclosed
US-4970207-A Benzodiazepine derivatives FUJISAWA PHARMACEUTICAL COMPANY, LTD. (JP) 1990-11-13 US disclosed
EP-0349949-A2 Benzodiazepine derivatives FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1990-01-10 EP disclosed