SCHEMBL6132431

SCHEMBL6132431

CCCC(Br)OC1CCN(C(=O)OC(C)(C)C)CC1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HPGD P15428 1/20 0.45
▸ PDE4D Q08499 3/20 0.43
▸ PDE4A P27815 2/20 0.43
▸ PDE4B Q07343 2/20 0.43
▸ PDE4C Q08493 2/20 0.43
▸ RECQL P46063 1/20 0.43
▸ EPHX1 P07099 1/20 0.43
▸ DPP4 P27487 1/20 0.42
▸ USP2 O75604 1/20 0.41
▸ SMN1; SMN2 Q16637 1/20 0.41
▸ GPR119 Q8TDV5 4/20 0.40
▸ NPC1 O15118 1/20 0.40
▸ ALDH1A1 P00352 1/20 0.40
▸ MAPT P10636 1/20 0.40
▸ MAPK1 P28482 1/20 0.40
▸ HTT P42858 1/20 0.40
▸ RAB9A P51151 1/20 0.40
▸ L3MBTL1 Q9Y468 1/20 0.40
▸ PRMT5 O14744 1/20 0.40
▸ WDR77 Q9BQA1 1/20 0.40

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
SCHEMBL7273992 0.82 HPGD (0.48) HPGDRECQLEPHX1DPP4USP2
SCHEMBL21026298 0.79 PDE4D (0.45) HPGDPDE4DPDE4APDE4BPDE4C
SCHEMBL26352077 0.79 HPGD (0.48) HPGDPDE4DPDE4APDE4BPDE4C
SCHEMBL25059157 0.79 CHRM1 (0.41) HPGDPDE4DPDE4APDE4BPDE4C
SCHEMBL5271932 0.78 HPGD (0.53) HPGDRECQLEPHX1DPP4USP2
SCHEMBL22907100 0.77 HPGD (0.49) HPGDRECQLEPHX1DPP4USP2
SCHEMBL19286080 0.77 GPR119 (0.54) HPGDPDE4DPDE4APDE4BPDE4C
SCHEMBL9032915 0.77 RECQL (0.52) HPGDRECQLEPHX1USP2SMN1; SMN2
SCHEMBL18015125 0.77 HPGD (0.51) HPGDPDE4DRECQLEPHX1DPP4
SCHEMBL4102689 0.77 EPHX1 (0.47) HPGDPDE4DPDE4APDE4BPDE4C

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
US-6884868-B1 Cyclic hexapeptides having antibiotic activity FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2005-04-26 — — US disclosed
Send feedback