SCHEMBL7267551

SCHEMBL7267551

CN1C2CCCC1CC(n1nnc3cc(N)c(Cl)cc3c1=O)C2

nearest known ligand 0.38

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ HTR4 Q13639 1/20 0.35
▸ HTR3A P46098 3/20 0.32
▸ HCAR3 P49019 1/20 0.32
▸ CHRNB4 P30926 1/20 0.32
▸ CHRNA3 P32297 1/20 0.32
▸ KAT2B Q92831 2/20 0.31
▸ MAPK1 P28482 1/20 0.31
▸ ADORA2A P29274 1/20 0.30

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
SCHEMBL7276249 0.95 HTR4 (0.39) HTR4HTR3AKAT2B
SCHEMBL7267544 0.84 PGK1 (0.33) HTR3AHCAR3CHRNB4CHRNA3KAT2B
SCHEMBL7266786 0.76 GPR139 (0.39) —
SCHEMBL7267651 0.76 HTR4 (0.31) HTR4ADORA2A
SCHEMBL7267645 0.76 HTR4 (0.31) HTR4ADORA2A
SCHEMBL7268093 0.74 HTR4 (0.39) HTR4HTR3AKAT2B
SCHEMBL7273660 0.71 — —
SCHEMBL7266973 0.70 ALDH1A1 (0.49) HTR3AMAPK1
SCHEMBL7273132 0.67 PIK3CA (0.33) —
SCHEMBL2824624 0.63 KDM4E (0.40) HCAR3MAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0315390-B1 Novel 4-oxobenzotriazines and 4-oxoquinazolines BEECHAM GROUP PLC (GB) 1994-07-20 — — EP claimed
US-4959367-A ANALGESICS, TRANQUILIZERS, GASTROINTESTINAL, CNS BEECHAM GROUP P.L.C. (GB) 1990-09-25 — — US claimed
EP-0315390-A2 Novel 4-oxobenzotriazines and 4-oxoquinazolines BEECHAM GROUP PLC (GB) 1989-05-10 — — EP claimed
EP-0315390-B1 Novel 4-oxobenzotriazines and 4-oxoquinazolines BEECHAM GROUP PLC (GB) 1994-07-20 — — EP disclosed
EP-0315390-A2 Novel 4-oxobenzotriazines and 4-oxoquinazolines BEECHAM GROUP PLC (GB) 1989-05-10 — — EP disclosed
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