SCHEMBL28492

SCHEMBL28492

Cn1cccc1C(=O)N1CCN(C(=O)Nc2ccc(N3CCC(C(=O)CCN4CCOCC4)CC3)cc2)CC1

nearest known ligand 0.81

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
HPGDS O60760 20/20 0.81
CRBN Q96SW2 1/20 0.51

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
SCHEMBL28315 0.89 HPGDS (1.00) HPGDSCRBN
SCHEMBL9998846 0.88 HPGDS (1.00) HPGDSCRBN
SCHEMBL28755 0.87 HPGDS (1.00) HPGDS
SCHEMBL29363 0.87 HPGDS (1.00) HPGDSCRBN
SCHEMBL28790523 0.82 HPGDS (0.73) HPGDSCRBN
SCHEMBL27841 0.81 HPGDS (1.00) HPGDSCRBN
SCHEMBL27787 0.81 HPGDS (1.00) HPGDSCRBN
SCHEMBL28314 0.81 HPGDS (0.73) HPGDSCRBN
SCHEMBL27589 0.80 HPGDS (1.00) HPGDSCRBN
SCHEMBL23017395 0.79 HPGDS (0.73) HPGDSCRBN

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
EP-2407466-A1 PIPERAZINE COMPOUND CAPABLE OF INHIBITING PROSTAGLANDIN D SYNTHASE Taiho Pharmaceutical Co., Ltd. (JP) 2012-01-18 EP claimed
EP-2407466-A1 PIPERAZINE COMPOUND CAPABLE OF INHIBITING PROSTAGLANDIN D SYNTHASE Taiho Pharmaceutical Co., Ltd. (JP) 2012-01-18 EP disclosed