SCHEMBL4877772

SCHEMBL4877772

Cc1nc(C)c(-c2ccc3cc(-c4c(-c5ccccc5)c5sc(C(=O)NS(C)(=O)=O)cc5n4CC(=O)O)ccc3n2)s1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.34
ALDH1A1 P00352 3/20 0.34
SMN1; SMN2 Q16637 3/20 0.34
COMT P21964 3/20 0.34
GAA P10253 1/20 0.34
RXFP1 Q9HBX9 1/20 0.34
KCNH2 Q12809 1/20 0.33
HRH3 Q9Y5N1 1/20 0.33
HTT P42858 3/20 0.33
HSD17B10 Q99714 2/20 0.32
LMNA P02545 2/20 0.32
USP2 O75604 1/20 0.32
HPGD P15428 1/20 0.32
TSHR P16473 1/20 0.32
NAMPT P43490 2/20 0.32
PTGER4 P35408 1/20 0.31
PIN1 Q13526 1/20 0.30
SLC2A1 P11166 1/20 0.30
SLC2A3 P11169 1/20 0.30
SLC2A4 P14672 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
SCHEMBL4876350 0.94 ALDH1A1 (0.32) KDM4EALDH1A1SMN1; SMN2COMTGAA
SCHEMBL4876042 0.90 KDM4E (0.36) KDM4EALDH1A1COMTKCNH2HRH3
SCHEMBL3931430 0.89 KDM4E (0.35) KDM4EALDH1A1SMN1; SMN2COMTKCNH2
SCHEMBL4877213 0.87 CBX7 (0.35) KCNH2HRH3LMNA
SCHEMBL4877767 0.86 KCNH2 (0.37) RXFP1KCNH2HRH3
SCHEMBL4874128 0.85 SLC8A1 (0.33) KCNH2HRH3
SCHEMBL4878159 0.82 KCNH2 (0.34) COMTKCNH2HRH3NAMPT
SCHEMBL3942443 0.81 ALDH1A1 (0.34) KDM4EALDH1A1SMN1; SMN2COMTKCNH2
SCHEMBL4876347 0.81 GRIN2B (0.39) ALDH1A1SMN1; SMN2GAAKCNH2HRH3
SCHEMBL4876223 0.81 GRIN2B (0.39) ALDH1A1SMN1; SMN2GAAKCNH2HRH3

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 KDM4E 3075/4885ALDH1A1 1357/4885SMN1; SMN2 1929/4885

“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.