SCHEMBL4877262

SCHEMBL4877262

COC(=O)c1cc2[nH]c(-c3ccc4nc(-c5ccccc5F)ccc4c3)c(C3=CCCCC3)c2s1

nearest known ligand 0.33

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 1/20 0.33
CDK1 P06493 1/20 0.33
MAPKAPK2 P49137 1/20 0.33
BDKRB1 P46663 1/20 0.33
MAT2A P31153 1/20 0.32
PSMB5 P28074 3/20 0.31
KDM4E B2RXH2 1/20 0.31
ALDH1A1 P00352 1/20 0.31
HPGD P15428 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
MAP4K1 Q92918 1/20 0.31
SLC6A2 P23975 3/20 0.30
SLC6A3 Q01959 2/20 0.30
TACR3 P29371 1/20 0.30
SCD O00767 1/20 0.30
MAPT P10636 1/20 0.30
BACE1 P56817 1/20 0.30
SLC6A4 P31645 1/20 0.30
HDAC6 Q9UBN7 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
SCHEMBL3935580 0.87 BDKRB1 (0.36) BDKRB1ALDH1A1HPGDMAP4K1SLC6A2
SCHEMBL4877033 0.85 KCNH2 (0.35) MAT2APSMB5
SCHEMBL4874810 0.82 BDKRB1 (0.34) CDK1MAPKAPK2BDKRB1MAP4K1SLC6A2
SCHEMBL3000703 0.80 MAT2A (0.40) MAT2AKDM4EALDH1A1HPGDL3MBTL1
SCHEMBL2986580 0.76 SLC6A3 (0.39) KDM4ESLC6A2SLC6A3MAPT
SCHEMBL3941890 0.75 ALDH1A1 (0.36) BDKRB1ALDH1A1HPGDMAP4K1SLC6A2
SCHEMBL3930249 0.73 SMN1; SMN2 (0.37) KDM4EALDH1A1HPGDMAPT
SCHEMBL4872112 0.70 GRIN2B (0.39) MAPK1
SCHEMBL3930247 0.66 KCNH2 (0.38) MAT2AALDH1A1
SCHEMBL2987902 0.65 LMNA (0.45) KDM4EALDH1A1HPGDL3MBTL1MAPT

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-20080051384-A1 ANTIVIRAL AGENTS GENELABS TECHNOLOGIES, INC. 2008-02-28 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20080051384-A1 ANTIVIRAL AGENTS EIF2AK2, MAVS, ZC3HAV1 MAPK1 4078/4885CDK1 1613/4885MAPKAPK2 3456/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.