SCHEMBL8538152

SCHEMBL8538152

Cc1cccc(NC(=O)NC2N=C(c3ccccc3F)c3ccccc3N(Cc3cc(C)ccn3)C2=O)c1

nearest known ligand 0.71

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CCKBR P32239 10/20 0.71
CCKAR P32238 2/20 0.59
CYP3A4 P08684 1/20 0.58
MAPT P10636 1/20 0.58
TSHR P16473 1/20 0.58

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
SCHEMBL9057111 1.00 CCKBR (0.71) CCKBRCCKARCYP3A4MAPTTSHR
SCHEMBL9057807 0.94 CCKBR (0.67) CCKBRCCKAR
SCHEMBL8534435 0.94 CCKBR (0.67) CCKBRCCKAR
SCHEMBL8538375 0.94 CCKBR (0.71) CCKBRCCKAR
SCHEMBL8534654 0.92 CCKBR (0.65) CCKBRCCKAR
SCHEMBL8775008 0.92 CCKBR (0.65) CCKBRCCKAR
SCHEMBL9054618 0.92 CCKBR (0.65) CCKBRCCKAR
SCHEMBL8586019 0.92 CCKBR (0.65) CCKBRCCKAR
SCHEMBL8774027 0.90 CCKBR (0.77) CCKBRCCKARCYP3A4MAPTTSHR
SCHEMBL8538302 0.90 CCKBR (0.77) CCKBRCCKARCYP3A4MAPTTSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5763437-A Benzodiazepine derivatives FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1998-06-09 US disclosed
WO-1996004254-A2 BENZODIAZEPINE DERIVATIVES FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1996-02-15 WO disclosed