SCHEMBL4877495

SCHEMBL4877495

CC1CCCN1C(=O)Cn1c(-c2ccc3nc(-c4cccn4C)ccc3c2)c(C2CCCCC2)c2sc(C(=O)O)cc21

nearest known ligand 0.48

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
KCNH2 Q12809 11/20 0.34
HRH3 Q9Y5N1 11/20 0.34
MAPT P10636 1/20 0.33
USP2 O75604 1/20 0.33
POLB P06746 1/20 0.33
MAPK1 P28482 2/20 0.33
KDM4E B2RXH2 1/20 0.32
ALDH1A1 P00352 1/20 0.32
LMNA P02545 1/20 0.32
HPGD P15428 1/20 0.32
HTT P42858 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
TSHR P16473 1/20 0.32

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
SCHEMBL4877504 0.91 KCNH2 (0.38) KCNH2HRH3USP2POLBMAPK1
SCHEMBL4876060 0.89 ALDH1A1 (0.40) KCNH2HRH3MAPTMAPK1KDM4E
SCHEMBL4878273 0.87 KCNH2 (0.34) KCNH2HRH3MAPTUSP2POLB
SCHEMBL4865027 0.87 MAPT (0.33) KCNH2HRH3MAPTUSP2POLB
SCHEMBL4875594 0.87 KCNH2 (0.44) KCNH2HRH3MAPTUSP2POLB
SCHEMBL4878059 0.86 KDM4E (0.38) KCNH2HRH3MAPTUSP2POLB
SCHEMBL4876386 0.86 MAPT (0.35) KCNH2HRH3MAPTUSP2POLB
SCHEMBL4883869 0.86 CBX7 (0.35) ALDH1A1
SCHEMBL4878855 0.85 MAPT (0.34) KCNH2HRH3MAPTUSP2POLB
SCHEMBL4868302 0.85 MAOA (0.37) KCNH2HRH3MAPT

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080051384-A1 ANTIVIRAL AGENTS GENELABS TECHNOLOGIES, INC. 2008-02-28 US disclosed
US-20080051384-A1 ANTIVIRAL AGENTS GENELABS TECHNOLOGIES, INC. 2008-02-28 US disclosed
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 KCNH2 2647/4885HRH3 4258/4885MAPT 4372/4885

“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.