SCHEMBL9121916

SCHEMBL9121916

O=C(Nc1ccc(Cl)cc1)NC1N=C(c2ccccc2)c2cccc3c2N(CC3)C1=O

nearest known ligand 0.68

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ PDE4A P27815 10/20 0.68
▸ PDE4B Q07343 10/20 0.68
▸ PDE4C Q08493 10/20 0.68
▸ PDE4D Q08499 10/20 0.68
▸ CCKBR P32239 10/20 0.64
▸ PDE3B Q13370 3/20 0.60
▸ PDE3A Q14432 3/20 0.60
▸ PDE5A O76074 2/20 0.59
▸ PDE1A P54750 2/20 0.59
▸ PDE1B Q01064 2/20 0.59
▸ PDE1C Q14123 2/20 0.59

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
SCHEMBL9123005 0.89 CCKBR (0.60) PDE4APDE4BPDE4CPDE4DCCKBR
SCHEMBL9122239 0.87 PDE4A (0.70) PDE4APDE4BPDE4CPDE4DCCKBR
SCHEMBL9226379 0.85 CCKBR (0.61) CCKBR
SCHEMBL9123614 0.84 CCKBR (0.68) PDE4APDE4BPDE4CPDE4DCCKBR
SCHEMBL14468290 0.83 PDE4A (0.74) PDE4APDE4BPDE4CPDE4DPDE3B
SCHEMBL7499624 0.82 PDE4A (0.76) PDE4APDE4BPDE4CPDE4DPDE3B
SCHEMBL7497465 0.82 PDE4A (0.79) PDE4APDE4BPDE4CPDE4DPDE3B
SCHEMBL7493301 0.81 PDE4A (0.78) PDE4APDE4BPDE4CPDE4DCCKBR
SCHEMBL9119450 0.81 PDE4A (0.74) PDE4APDE4BPDE4CPDE4DCCKBR
SCHEMBL14193482 0.80 PDE4A (0.70) PDE4APDE4BPDE4CPDE4DCCKBR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5461048-A Tricyclic compounds having cholecystokinin antagonist activity FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1995-10-24 — — US disclosed
US-5401737-A Tricyclic compounds FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1995-03-28 — — US disclosed
EP-0360079-B1 Tricyclic compounds, processes for their preparation and pharmaceutical compositions comprising them FUJISAWA PHARMACEUTICAL CO (JP) 1994-02-02 — — EP disclosed
US-5248679-A Tricyclic compounds FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1993-09-28 — — US disclosed
US-5155101-A Tricyclic compounds FUJISAWA PHARMACEUTICAL COMPANY, LTD. (JP) 1992-10-13 — — US disclosed
US-4981847-A Tricyclic compounds FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1991-01-01 — — US disclosed
EP-0360079-A1 Tricyclic compounds, processes for their preparation and pharmaceutical compositions comprising them FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1990-03-28 — — EP disclosed
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