SCHEMBL29852391

SCHEMBL29852391

CCOC(=O)CCc1ccnc(C(=O)O)c1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP4F2 P78329 2/20 0.51
CYP4A11 Q02928 2/20 0.51
SYK P43405 8/20 0.44
PDE3B Q13370 1/20 0.44
PDE3A Q14432 1/20 0.44
P2RY12 Q9H244 1/20 0.44
KDM4E B2RXH2 3/20 0.42
ALDH1A1 P00352 3/20 0.42
KDM6B O15054 1/20 0.42
TET3 O43151 1/20 0.42
KDM4A O75164 1/20 0.42
BBOX1 O75936 1/20 0.42
MAPT P10636 1/20 0.42
KDM5A P29375 1/20 0.42
KDM5C P41229 1/20 0.42
ASPH Q12797 1/20 0.42
KDM4D Q6B0I6 1/20 0.42
TET2 Q6N021 1/20 0.42
ALKBH5 Q6P6C2 1/20 0.42
KDM7A Q6ZMT4 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
SCHEMBL16318640 0.84 CYP4F2 (0.55) CYP4F2CYP4A11SYKPDE3BPDE3A
SCHEMBL10375085 0.82 CYP4F2 (0.54) CYP4F2CYP4A11SYKPDE3BPDE3A
SCHEMBL27224530 0.82 CYP4F2 (0.54) CYP4F2CYP4A11SYKPDE3BPDE3A
SCHEMBL16318580 0.81 CYP4F2 (0.56) CYP4F2CYP4A11SYKPDE3BPDE3A
SCHEMBL21476229 0.81 CYP4F2 (0.53) CYP4F2CYP4A11SYKPDE3BPDE3A
SCHEMBL20103289 0.81 CYP4F2 (0.53) CYP4F2CYP4A11SYKPDE3BPDE3A
SCHEMBL10375080 0.80 SYK (0.54) CYP4F2CYP4A11SYKPDE3BPDE3A
SCHEMBL4863083 0.80 ALDH1A1 (0.52) CYP4F2CYP4A11KDM4EALDH1A1KDM6B
SCHEMBL7039459 0.79 CYP4F2 (0.50) CYP4F2CYP4A11SYKPDE3BPDE3A
SCHEMBL27224523 0.79 CYP4F2 (0.50) CYP4F2CYP4A11SYKPDE3BPDE3A

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-4059933-A1 AZABENZIMIDAZOLE COMPOUND AND MEDICINE Nippon Shinyaku Co., Ltd. (JP) 2022-09-21 EP disclosed
CN-114929697-A Azabenzimidazole compounds and medicaments 日本新药株式会社 2022-08-19 CN disclosed