SCHEMBL8476328

SCHEMBL8476328

CCCc1[c]cc(-c2ccccc2)c(-c2ccccc2)c1OC

nearest known ligand 0.40

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PDE4B Q07343 6/20 0.40
PDE4A P27815 5/20 0.40
PDE4C Q08493 5/20 0.40
PDE4D Q08499 5/20 0.40
MGAM O43451 5/20 0.33
GAA P10253 5/20 0.33
SI P14410 5/20 0.33
MGAM2 Q2M2H8 5/20 0.33
ADRB2 P07550 1/20 0.31
NPC1 O15118 1/20 0.30
RAB9A P51151 1/20 0.30
ADORA3 P0DMS8 1/20 0.30
ADORA2A P29274 1/20 0.30
ADORA1 P30542 1/20 0.30
GCGR P47871 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
SCHEMBL8477677 0.88 PDE4B (0.43) PDE4BPDE4APDE4CPDE4DMGAM
SCHEMBL8477540 0.88 PDE4B (0.42) PDE4BPDE4APDE4CPDE4DMGAM
SCHEMBL8475248 0.87 MGAM (0.33) MGAMGAASIMGAM2GCGR
SCHEMBL8474110 0.80 GCGR (0.35) NPC1RAB9AADORA3ADORA2AADORA1
SCHEMBL8474107 0.77 LTA4H (0.34) PDE4BPDE4APDE4CPDE4D
SCHEMBL8479313 0.76 PDE4B (0.45) PDE4BPDE4APDE4CPDE4DMGAM
SCHEMBL8476879 0.75 GAA (0.40) MGAMGAASIMGAM2
SCHEMBL8478249 0.75 LTA4H (0.41) MGAMGAASIMGAM2NPC1
SCHEMBL8479825 0.75 USP7 (0.33) MGAMGAASIMGAM2
SCHEMBL8475575 0.75 PDE4B (0.44) PDE4BPDE4APDE4CPDE4D

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
US-6004988-A Carboxylic acid derivatives, their preparation and their use BASF AKTIENGESELLSCHAFT (DE) 1999-12-21 US disclosed