SCHEMBL7587091

SCHEMBL7587091

CCN1CCN(CC)C(c2ccccc2)C1.COc1ccc2cc1-2

nearest known ligand 0.42

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
P2RX7 Q99572 1/20 0.41
NPC1 O15118 1/20 0.39
RAB9A P51151 1/20 0.39
MAPK1 P28482 1/20 0.39
HSD17B10 Q99714 1/20 0.39
HTR7 P34969 2/20 0.38
DRD2 P14416 8/20 0.38
DRD3 P35462 8/20 0.38
TACR1 P25103 1/20 0.38
DPP4 P27487 1/20 0.37
LMNA P02545 1/20 0.37
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
ACHE P22303 1/20 0.37

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
SCHEMBL7582945 0.92 P2RX7 (0.41) P2RX7HTR7DRD2DRD3DPP4
SCHEMBL7583788 0.92 P2RX7 (0.41) P2RX7NPC1RAB9AMAPK1HSD17B10
SCHEMBL7582092 0.87 P2RX7 (0.40) P2RX7DRD2DRD3DPP4
SCHEMBL7585483 0.85 P2RX7 (0.41) P2RX7DRD2DRD3DPP4LMNA
SCHEMBL7589899 0.84 NAAA (0.45) P2RX7RAB9ADRD2DRD3DPP4
SCHEMBL27419636 0.84 P2RX7 (0.40) P2RX7MAPK1HTR7DRD2DRD3
SCHEMBL7590018 0.84 DRD2 (0.41) P2RX7DRD2DRD3LMNAMEN1
SCHEMBL27489861 0.83 P2RX7 (0.50) P2RX7DRD2DRD3LMNA
SCHEMBL7583781 0.83 P2RX7 (0.51) P2RX7NPC1RAB9ATACR1MEN1
SCHEMBL7583792 0.81 DRD2 (0.41) P2RX7DRD2DRD3LMNA

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