SCHEMBL9122249

SCHEMBL9122249

O=C(N[C@H]1N=C(c2ccccc2F)c2ccccc2N(CCO)C1=O)c1cc2ccccc2[nH]1

nearest known ligand 0.81

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CCKBR P32239 20/20 0.81
CCKAR P32238 15/20 0.81
ADRB2 P07550 1/20 0.62
TSPO P30536 1/20 0.62
GLP1R P43220 1/20 0.62
FFAR4 Q5NUL3 1/20 0.62

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
SCHEMBL9127549 1.00 CCKBR (0.81) CCKBRCCKARADRB2TSPOGLP1R
SCHEMBL9122241 1.00 CCKBR (0.81) CCKBRCCKARADRB2TSPOGLP1R
SCHEMBL9459508 0.91 CCKBR (0.78) CCKBRCCKARADRB2TSPOGLP1R
SCHEMBL9459515 0.91 CCKBR (0.78) CCKBRCCKARADRB2TSPOGLP1R
SCHEMBL9525011 0.90 CCKBR (1.00) CCKBRCCKARADRB2TSPOGLP1R
SCHEMBL9525022 0.90 CCKBR (1.00) CCKBRCCKARADRB2TSPOGLP1R
SCHEMBL9459250 0.90 CCKBR (0.82) CCKBRCCKARADRB2TSPOGLP1R
SCHEMBL9124795 0.90 CCKBR (0.82) CCKBRCCKARADRB2TSPOGLP1R
SCHEMBL9124789 0.90 CCKBR (0.82) CCKBRCCKARADRB2TSPOGLP1R
SCHEMBL9126258 0.89 CCKBR (0.75) 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