SCHEMBL2767326

SCHEMBL2767326

C[C@H]1CN(Cc2ccc(N(C)C(=O)c3cccc(Oc4ccc(F)cc4)c3)cc2)CCN1C(=O)O

nearest known ligand 0.62

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
MLNR O43193 14/20 0.62
MGLL Q99685 3/20 0.54
CCR1 P32246 1/20 0.49
CCR3 P51677 1/20 0.43

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
SCHEMBL2765885 0.94 MLNR (0.65) MLNRMGLLCCR1CCR3
SCHEMBL2765421 0.92 MLNR (0.73) MLNRMGLLCCR1
SCHEMBL2765627 0.91 MLNR (0.61) MLNRMGLLCCR1
SCHEMBL3567358 0.90 MLNR (0.58) MLNRMGLLCCR1
SCHEMBL2766758 0.87 MLNR (0.58) MLNRMGLLCCR1
SCHEMBL2766514 0.85 MLNR (0.84) MLNR
SCHEMBL2766234 0.85 MLNR (0.74) MLNRMGLLCCR1
SCHEMBL2768337 0.85 MLNR (0.57) MLNRMGLLCCR1
SCHEMBL2767206 0.84 MLNR (0.61) MLNRMGLLCCR1
SCHEMBL2767224 0.84 MLNR (0.75) MLNRMGLLCCR1

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
EP-2041093-B1 PIPERAZINYL DERIVATIVES USEFUL IN THE TREATMENT OF GPR38 RECEPTOR MEDIATED DISEASES GLAXO GROUP LTD (GB) 2010-04-21 EP disclosed