SCHEMBL30740975

SCHEMBL30740975

CCOC(=O)c1cc(-c2ccc(Cl)c(C(F)(F)F)c2)[nH]c1-c1ccccc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GCGR P47871 2/20 0.56
MAPT P10636 3/20 0.50
TP53 P04637 1/20 0.50
PDE3B Q13370 2/20 0.49
PDE3A Q14432 2/20 0.49
DHODH Q02127 1/20 0.48
MDM2 Q00987 1/20 0.43
BRAF P15056 2/20 0.42
CYP1A2 P05177 2/20 0.42
RAB9A P51151 1/20 0.42
KDM4E B2RXH2 4/20 0.41
HPGD P15428 3/20 0.41
ALDH1A1 P00352 2/20 0.41
HSD17B10 Q99714 2/20 0.41
MEN1 O00255 1/20 0.41
LMNA P02545 1/20 0.41
GAA P10253 1/20 0.41
MAPK10 P53779 1/20 0.41
KMT2A Q03164 1/20 0.41
PTGES O14684 2/20 0.41

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
SCHEMBL29158849 0.84 PDE3B (0.52) GCGRMAPTPDE3BPDE3AMDM2
SCHEMBL30740993 0.82 GCGR (0.63) GCGRMAPTPDE3BPDE3AMDM2
SCHEMBL30741005 0.81 GCGR (0.58) GCGRMAPTPDE3BPDE3AMDM2
SCHEMBL30741049 0.80 PDE3B (0.55) GCGRMAPTPDE3BPDE3AMDM2
SCHEMBL29159037 0.80 GCGR (0.57) GCGRMAPTPDE3BPDE3AMDM2
SCHEMBL29158848 0.79 GCGR (0.65) GCGRMAPTTP53PDE3BPDE3A
SCHEMBL30740926 0.79 GCGR (0.58) GCGRMAPTPDE3BPDE3ADHODH
SCHEMBL30741073 0.78 PDE3B (0.56) GCGRMAPTPDE3BPDE3AMDM2
SCHEMBL4181389 0.78 GCGR (0.64) GCGRMAPTTP53PDE3BPDE3A
SCHEMBL30741015 0.78 GCGR (0.60) GCGRMAPTTP53PDE3BPDE3A

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
CN-117396465-A Novel oxazole derivative for preventing or treating allergic diseases and pharmaceutical composition containing the same 阿斯克里斯有限公司 2024-01-12 CN disclosed