SCHEMBL8264405

SCHEMBL8264405

N=C(c1ccc(NC(=O)C(NC(=O)Nc2ccc(Cl)cc2)c2ccccc2)cc1)N1CCCC1

nearest known ligand 0.47

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.47
SMN1; SMN2 Q16637 1/20 0.46
S1PR4 O95977 1/20 0.46
S1PR3 Q99500 1/20 0.46
CNR1 P21554 1/20 0.44
EP300 Q09472 2/20 0.44
MAPT P10636 2/20 0.44
F10 P00742 4/20 0.44
F7 P08709 1/20 0.44
PRSS1 P07477 1/20 0.43
LMNA P02545 1/20 0.43
FPR2 P25090 1/20 0.43
NPC1 O15118 2/20 0.43
RAB9A P51151 1/20 0.43
ADRB2 P07550 1/20 0.43
NPSR1 Q6W5P4 1/20 0.43
KDM4E B2RXH2 1/20 0.42
GAA P10253 1/20 0.42
HTT P42858 1/20 0.42

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
SCHEMBL8264385 0.98 ALDH1A1 (0.47) ALDH1A1SMN1; SMN2S1PR4S1PR3CNR1
SCHEMBL8265537 0.90 ALDH1A1 (0.46) ALDH1A1SMN1; SMN2S1PR4S1PR3CNR1
SCHEMBL8264515 0.88 F10 (0.45) MAPTF10F7
SCHEMBL8264058 0.88 MAPT (0.45) ALDH1A1SMN1; SMN2CNR1MAPTF10
SCHEMBL8265403 0.86 F10 (0.42) ALDH1A1SMN1; SMN2CNR1EP300MAPT
SCHEMBL13439351 0.86 F10 (0.44) ALDH1A1SMN1; SMN2CNR1MAPTF10
SCHEMBL8264054 0.86 F10 (0.42) ALDH1A1SMN1; SMN2CNR1MAPTF10
SCHEMBL8262956 0.86 MAPT (0.43) ALDH1A1SMN1; SMN2CNR1MAPTF10
SCHEMBL8264020 0.86 F10 (0.43) ALDH1A1S1PR4S1PR3EP300MAPT
SCHEMBL8264410 0.85 F10 (0.42) ALDH1A1SMN1; SMN2CNR1MAPTF10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7678913-B2 Ureas as factor Xa inhibitors PORTOLA PHARMACEUTICALS, INC. (US) 2010-03-16 US disclosed
US-7678913-B2 Ureas as factor Xa inhibitors PORTOLA PHARMACEUTICALS, INC. (US) 2010-03-16 US disclosed
WO-2006063113-A2 UREAS AS FACTOR XA INHIBITORS PORTOLA PHARMACEUTICALS, INC. (US) 2006-06-15 WO disclosed