SCHEMBL31229372

SCHEMBL31229372

O=C(O)c1ccnc(-c2ccn[nH]2)n1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP4F2 P78329 9/20 0.50
CYP4A11 Q02928 9/20 0.50
CD74 P04233 1/20 0.46
MIF P14174 1/20 0.46
BCAT2 O15382 2/20 0.44
KDM4E B2RXH2 3/20 0.44
KDM5A P29375 2/20 0.44
KDM3A Q9Y4C1 2/20 0.44
JMJD1C Q15652 1/20 0.44
HCAR2 Q8TDS4 2/20 0.43
KDM6B O15054 1/20 0.41
TET3 O43151 1/20 0.41
KDM4A O75164 1/20 0.41
BBOX1 O75936 1/20 0.41
ALDH1A1 P00352 1/20 0.41
MAPT P10636 1/20 0.41
KDM5C P41229 1/20 0.41
ASPH Q12797 1/20 0.41
KDM4D Q6B0I6 1/20 0.41
TET2 Q6N021 1/20 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
SCHEMBL28051951 0.85 CYP4F2 (0.43) CYP4F2CYP4A11CD74MIFBCAT2
SCHEMBL1505808 0.80 KDM4E (0.57) MIFKDM4EKDM5AKDM3AJMJD1C
SCHEMBL18168050 0.73 IRAK4 (0.59) CYP4F2CYP4A11CD74MIFKDM4E
SCHEMBL696116 0.72 XDH (0.50) CYP4F2CYP4A11KDM4EKDM5AKDM3A
SCHEMBL474231 0.72 HCAR2 (0.43) BCAT2KDM4EHCAR2ALDH1A1HPGDS
SCHEMBL30039691 0.72 CD38 (0.53) BCAT2ALOX15TSHR
Hydrochloric Acid SCHEMBL7968706 0.70 XDH (0.49) CYP4F2CYP4A11KDM4EKDM5AKDM3A
SCHEMBL18622292 0.69 SCN4A (0.54) CD74MIFBCAT2KDM4EHCAR2
SCHEMBL17431579 0.69 KDM4E (0.52) KDM4EKDM5AKDM3AJMJD1CKDM6B
SCHEMBL5322800 0.68 CD74 (0.65) CYP4F2CYP4A11CD74MIFBCAT2

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-4676918-A1 COMPOUNDS AND THEIR USES AS GPR183 INHIBITORS Nanjing Immunophage Biomedical Co., Ltd. (CN) 2026-01-14 EP disclosed
WO-2024208303-A1 COMPOUNDS AND THEIR USES AS GPR183 INHIBITORS NANJING IMMUNOPHAGE BIOTECH CO., LTD (CN) 2024-10-10 WO disclosed