SCHEMBL7699773

SCHEMBL7699773

CN1CCN(Cc2cc(C3c4ccccc4CCN3C=CC=O)nn2C)CC1

nearest known ligand 0.33

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
PRCP P42785 2/20 0.33
ERN1 O75460 1/20 0.33
PLA2G7 Q13093 1/20 0.33
MGLL Q99685 1/20 0.33
ABHD6 Q9BV23 1/20 0.33
DRD4 P21917 1/20 0.32
DRD3 P35462 1/20 0.32
FNTA P49354 2/20 0.32
FNTB P49356 2/20 0.32
ADRA1D P25100 1/20 0.32
ADRA1A P35348 1/20 0.32
ADRA1B P35368 1/20 0.32
MC4R P32245 1/20 0.32
SIGMAR1 Q99720 3/20 0.31
HTT P42858 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
ACHE P22303 1/20 0.31
NMT1 P30419 1/20 0.31
DRD1 P21728 1/20 0.30

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
SCHEMBL7702779 0.92 LMNA (0.35) PRCPERN1L3MBTL1
SCHEMBL7702491 0.76 SMN1; SMN2 (0.38) PRCPSIGMAR1
SCHEMBL7699898 0.75 BCHE (0.34) PRCPERN1HTTL3MBTL1
SCHEMBL7706720 0.74 PRCP (0.38) PRCPADRA1DADRA1AADRA1BSIGMAR1
SCHEMBL8508079 0.74 MC4R (0.38) PLA2G7MGLLABHD6DRD4DRD3
SCHEMBL7703165 0.73 PRCP (0.35) PRCPHTTL3MBTL1DRD1
SCHEMBL7704135 0.73 GAA (0.43) PRCPDRD4DRD3MC4R
SCHEMBL7704140 0.73 GAA (0.43) PRCPDRD4DRD3MC4R
SCHEMBL7697817 0.73 CYP2A13 (0.34) PRCPDRD4DRD3L3MBTL1
SCHEMBL7705571 0.73 ALDH1A1 (0.35) PRCPL3MBTL1

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-0901488-B1 2,4-DIAMINOPYRIMIDINE DERIVATIVES BASILEA PHARMACEUTICA AG (CH) 2002-11-06 EP disclosed