SCHEMBL30690128

SCHEMBL30690128

Cn1c(=O)oc2ccc(F)cc21

nearest known ligand 0.53

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CD74 P04233 1/20 0.53
MIF P14174 1/20 0.53
GPR55 Q9Y2T6 3/20 0.52
IDO1 P14902 3/20 0.51
KMT2A Q03164 2/20 0.49
MEN1 O00255 1/20 0.49
CBX7 O95931 4/20 0.46
CDYL Q9Y232 4/20 0.46
CDYL2 Q8N8U2 3/20 0.46
CDY1; CDY1B Q9Y6F8 2/20 0.46
LMNA P02545 1/20 0.46
TP53 P04637 1/20 0.46
PKM P14618 1/20 0.46
DDB1 Q16531 1/20 0.46
CRBN Q96SW2 1/20 0.46
ATM Q13315 1/20 0.44
ALDH1A1 P00352 1/20 0.42
HPGD P15428 1/20 0.42
POLB P06746 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
SCHEMBL5252825 1.00 CD74 (0.53) CD74MIFGPR55IDO1KMT2A
SCHEMBL5539787 0.85 MEN1 (0.59) GPR55KMT2AMEN1LMNATP53
SCHEMBL434086 0.79 MIF (0.54) CD74MIFKMT2AMEN1LMNA
SCHEMBL9372564 0.79 ATM (0.53) CD74MIFGPR55IDO1KMT2A
SCHEMBL5546434 0.78 CD74 (0.53) CD74MIFIDO1KMT2ACBX7
SCHEMBL399737 0.78 DDB1 (0.46) GPR55KMT2ALMNAPKMDDB1
SCHEMBL5544722 0.78 IDO1 (0.57) IDO1TP53PKMALDH1A1
SCHEMBL614398 0.78 SIGMAR1 (0.47) GPR55CBX7CDYLCDYL2CDY1; CDY1B
SCHEMBL18940725 0.78 DDB1 (0.46) GPR55KMT2AMEN1LMNAPKM
SCHEMBL3330251 0.78 PKM (0.49) CD74MIFPKMDDB1CRBN

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-117304205-A Benzimidazole ternary fused ring compound, pharmaceutically acceptable salt thereof and application thereof 中国科学院广州生物医药与健康研究院 2023-12-29 CN disclosed