SCHEMBL5779043

SCHEMBL5779043

NC(=O)c1ccc(Cl)c(C(=O)NC(O)C2CCCCCC2)c1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
METAP2 P50579 3/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
HPGD P15428 1/20 0.41
BCAT2 O15382 1/20 0.40
NPC1 O15118 2/20 0.39
RAB9A P51151 2/20 0.39
AKT1 P31749 1/20 0.39
METAP1 P53582 1/20 0.38
SLC6A3 Q01959 1/20 0.38
TAS1R3 Q7RTX0 1/20 0.38
TAS1R1 Q7RTX1 1/20 0.38
TAS1R2 Q8TE23 1/20 0.38
CHEK2 O96017 1/20 0.38
CNR2 P34972 1/20 0.38
HDAC8 Q9BY41 1/20 0.38
CA12 O43570 1/20 0.38
CA1 P00915 1/20 0.38
CA2 P00918 1/20 0.38
CA3 P07451 1/20 0.38
CA4 P22748 1/20 0.38

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
SCHEMBL12484097 0.83 P2RX7 (0.44) METAP2SMN1; SMN2HPGDNPC1RAB9A
SCHEMBL4481164 0.80 SMN1; SMN2 (0.41) METAP2SMN1; SMN2HPGDNPC1RAB9A
SCHEMBL5598264 0.79 RAB9A (0.54) SMN1; SMN2HPGDNPC1RAB9ATAS1R3
SCHEMBL12484029 0.78 P2RX7 (0.38) METAP2SMN1; SMN2HPGDAKT1CNR2
SCHEMBL4468343 0.77 SMN1; SMN2 (0.39) METAP2SMN1; SMN2HPGDNPC1RAB9A
SCHEMBL12483302 0.77 MEN1 (0.46) METAP2SMN1; SMN2HPGDKMT2AMEN1
SCHEMBL18835452 0.77 HPGD (0.55) SMN1; SMN2HPGDNPC1RAB9ACA12
SCHEMBL4473225 0.75 NOTUM (0.40) METAP2AKT1
SCHEMBL12483241 0.75 FPR2 (0.40) METAP2SMN1; SMN2HPGDAKT1PYGL
SCHEMBL12483172 0.75 GRM4 (0.41) SMN1; SMN2NPC1RAB9AAKT1

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-1626962-A1 BENZAMIDE INHIBITORS OF THE P2X7 RECEPTOR Pfizer Products Inc. (US) 2006-02-22 EP disclosed
WO-2004099146-A1 BENZAMIDE INHIBITORS OF THE P2X7 RECEPTOR PFIZER PRODUCTS INC. (US) 2004-11-18 WO disclosed