SCHEMBL7582092

SCHEMBL7582092

CCN1CCN(N)CC1c1ccccc1.COc1ccc2cc1-2

nearest known ligand 0.40

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
P2RX7 Q99572 1/20 0.40
DPP4 P27487 1/20 0.39
DRD2 P14416 9/20 0.39
DRD3 P35462 9/20 0.39
FFAR2 O15552 2/20 0.38
NAAA Q02083 2/20 0.35
PTPRC P08575 1/20 0.35
PTPN1 P18031 1/20 0.35
HTR2C P28335 2/20 0.35
MAOA P21397 1/20 0.35

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
SCHEMBL7587091 0.87 P2RX7 (0.41) P2RX7DPP4DRD2DRD3
SCHEMBL7589899 0.86 NAAA (0.45) P2RX7DPP4DRD2DRD3NAAA
SCHEMBL7590018 0.85 DRD2 (0.41) P2RX7DRD2DRD3PTPRCPTPN1
SCHEMBL7585483 0.84 P2RX7 (0.41) P2RX7DPP4DRD2DRD3FFAR2
SCHEMBL7583788 0.84 P2RX7 (0.41) P2RX7DPP4DRD2DRD3
SCHEMBL7582945 0.84 P2RX7 (0.41) P2RX7DPP4DRD2DRD3FFAR2
SCHEMBL27419636 0.83 P2RX7 (0.40) P2RX7DPP4DRD2DRD3
SCHEMBL7583781 0.82 P2RX7 (0.51) P2RX7FFAR2MAOA
SCHEMBL7583792 0.80 DRD2 (0.41) P2RX7DRD2DRD3PTPRCPTPN1
SCHEMBL7583803 0.79 DRD2 (0.39) P2RX7DRD2DRD3PTPRCPTPN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1114596-C Biphenyl derivatives EISAI CO LTD (JP) 2003-07-16 CN claimed
CN-1117966-A Biphenyl derivatives EISAI CO LTD (JP) 1996-03-06 CN claimed
CN-1114596-C Biphenyl derivatives EISAI CO LTD (JP) 2003-07-16 CN disclosed
CN-1412661-A Chinese character name code keyboard input method LU YUSHAN (CN) 2003-04-23 CN disclosed
EP-0675118-B1 Biphenylderivatives, process for their preparation and their use as medicaments EISAI CO LTD (JP) 2002-10-09 EP disclosed
CN-1290700-A Phenyl piperazine derivatives EISAI LTD (JP) 2001-04-11 CN disclosed