SCHEMBL2484084

SCHEMBL2484084

CCN(C)c1ccnc(Oc2ccc(-c3cn(-c4ccc(Oc5ccc(Cl)cc5)cc4)c(CC(C)C)n3)cc2)c1

nearest known ligand 0.50

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
AGER Q15109 7/20 0.50
NPC1 O15118 1/20 0.32
LMNA P02545 1/20 0.32
MAPK1 P28482 1/20 0.32
RAB9A P51151 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
NR1H2 P55055 1/20 0.32
MAPT P10636 2/20 0.32
TP53 P04637 1/20 0.32
CXCR1 P25024 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.31
ATM Q13315 1/20 0.31
FPR2 P25090 2/20 0.31
SCN9A Q15858 2/20 0.31
MEN1 O00255 1/20 0.31
HTT P42858 1/20 0.31
KMT2A Q03164 1/20 0.31
P2RX3 P56373 2/20 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
SCHEMBL6895795 0.91 AGER (0.41) AGERNPC1LMNAMAPK1RAB9A
SCHEMBL6895313 0.80 AGER (0.51) AGERNPC1LMNAMAPK1RAB9A
SCHEMBL1283498 0.80 AGER (0.55) AGERNPC1LMNAMAPK1RAB9A
SCHEMBL1283344 0.80 AGER (0.55) AGERNPC1LMNAMAPK1RAB9A
SCHEMBL1283677 0.80 AGER (0.57) AGERNPC1LMNAMAPK1RAB9A
SCHEMBL1283836 0.79 AGER (0.78) AGERCXCR1
SCHEMBL1283673 0.78 AGER (0.57) AGERNPC1LMNAMAPK1RAB9A
SCHEMBL1283582 0.78 AGER (0.72) AGERNR1H2
SCHEMBL13314509 0.77 AGER (0.52) AGERATM
SCHEMBL1282765 0.77 AGER (0.60) AGERNPC1LMNAMAPK1RAB9A

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-1482931-B1 MONO- AND BICYCLIC AZOLE DERIVATIVES THAT INHIBIT THE INTERACTION OF LIGANDS WITH RAGE TRANSTECH PHARMA INC (US) 2011-10-19 EP disclosed