SCHEMBL5792306

SCHEMBL5792306

CCc1nc2ccc(Oc3ccc(F)cc3)cc2c(=O)n1C[C@H]1CCCN(C(C)C)C1

nearest known ligand 0.81

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
GHSR Q92847 15/20 0.81
KCNH2 Q12809 8/20 0.81
CYP2D6 P10635 7/20 0.81

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
SCHEMBL10064690 0.90 GHSR (1.00) GHSRKCNH2CYP2D6
SCHEMBL29408727 0.90 GHSR (1.00) GHSRKCNH2CYP2D6
SCHEMBL2742704 0.90 GHSR (1.00) GHSRKCNH2CYP2D6
Hydrochloric Acid SCHEMBL29986549 0.89 GHSR (0.98) GHSRKCNH2CYP2D6
SCHEMBL5791507 0.88 GHSR (0.81) GHSRKCNH2CYP2D6
SCHEMBL5824128 0.85 GHSR (0.78) GHSRKCNH2CYP2D6
SCHEMBL20528764 0.85 CYP2D6 (1.00) GHSRKCNH2CYP2D6
SCHEMBL20528762 0.85 CYP2D6 (1.00) GHSRKCNH2CYP2D6
SCHEMBL5824130 0.85 GHSR (0.78) GHSRKCNH2CYP2D6
SCHEMBL5790809 0.83 GHSR (0.58) GHSRKCNH2CYP2D6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2006012577-A2 QUINAZOLINONE DERIVATIVES USEFUL FOR THE REGULATION OF GLUCOSE HOMEOSTASIS AND FOOD INTAKE BAYER PHARMACEUTICALS CORPORATION (US) 2006-02-02 WO claimed