SCHEMBL6848477

SCHEMBL6848477

Oc1ccccc1Cn1nnnc1-c1ccccc1

nearest known ligand 0.54

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
P2RX7 Q99572 4/20 0.54
ALDH1A1 P00352 3/20 0.53
POLB P06746 2/20 0.53
HTT P42858 1/20 0.53
KCNMA1 Q12791 2/20 0.51
HDAC6 Q9UBN7 1/20 0.51
HSD11B1 P28845 2/20 0.50
HPGD P15428 1/20 0.42
MPO P05164 1/20 0.42
KMT2A Q03164 1/20 0.41

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
SCHEMBL6361123 0.81 L3MBTL1 (0.58) P2RX7ALDH1A1POLBHTTHDAC6
SCHEMBL4403732 0.78 P2RX7 (0.81) P2RX7ALDH1A1POLBHTTHDAC6
SCHEMBL6357061 0.78 P2RX7 (0.56) P2RX7ALDH1A1POLBHTTHDAC6
SCHEMBL10631244 0.78 P2RX7 (0.54) P2RX7ALDH1A1POLBHTTHDAC6
SCHEMBL6362759 0.76 P2RX7 (0.75) P2RX7KCNMA1
SCHEMBL5651126 0.76 ALDH1A1 (0.62) P2RX7ALDH1A1POLBHTTHDAC6
SCHEMBL6357253 0.75 POLB (0.78) P2RX7ALDH1A1POLBHTTHDAC6
SCHEMBL10635287 0.73 ALDH1A1 (0.68) P2RX7ALDH1A1POLBHTTHDAC6
SCHEMBL1520494 0.73 HSD11B1 (0.58) P2RX7ALDH1A1POLBHTTHDAC6
SCHEMBL6362202 0.73 P2RX7 (0.68) P2RX7ALDH1A1POLBHTTHDAC6

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-2502919-A1 PROCESS FOR PRODUCTION OF BIPHENYL DERIVATIVE Mitsubishi Tanabe Pharma Corporation (JP) 2012-09-26 EP disclosed
WO-2011061996-A1 PROCESS FOR PRODUCTION OF BIPHENYL DERIVATIVE 田辺三菱製薬株式会社 (JP) 2011-05-26 WO disclosed